N-(2-{[(4-Bromo-1,2-thiazol-3-yl)methyl]sulfanyl}ethyl)-N'-methylthiourea

HCID 12923381CAS 57073-19-5

기본 정보

표준 SMILES
CNC(=S)NCCSCc1nscc1Br
InChIKey
FHMWSAPSSOSBSQ-UHFFFAOYSA-N
분자식
C8H12BrN3S3
평균 분자량
326.3 g/mol
단동위원소 질량
324.93767

이름 및 식별자

우선 이름
N-(2-{[(4-Bromo-1,2-thiazol-3-yl)methyl]sulfanyl}ethyl)-N'-methylthiourea
IUPAC
1-[2-[(4-bromo-1,2-thiazol-3-yl)methylsulfanyl]ethyl]-3-methylthiourea

이름 및 동의어

57073-19-5SCHEMBL11107760DTXSID60513065FHMWSAPSSOSBSQ-UHFFFAOYSA-NN-(2-{[(4-Bromo-1,2-thiazol-3-yl)methyl]sulfanyl}ethyl)-N'-methylthioureaN-methyl-N'-[2-((4-bromo-3-isothiazolyl) methylthio)ethyl]thioureaN-methyl-N'-[2-((4-bromo-3-isothiazolyl)-methylthio)ethyl]thioureaN-Methyl-N'-[2-((4-bromo-3-isothiazolyl)methylthio)ethyl]-thioureaN-methyl-N'-[2-((4-bromo-3-isothiazolyl)methylthio)ethyl]thioureaN-methyl-N-'-[2-((4-bromo-3-isothiazolyl)methylthio)ethyl]thiourea

데이터베이스 식별자

CAS
57073-19-5
PubChem CID
12923381
DTXSID
DTXSID60513065

물성

구조 계산 물성

XLogP
1.9
극성 표면적
123 Ų
수소 결합 공여자 수
2
수소 결합 수용자 수
4
회전 가능 결합 수
5
무거운 원자 수
15

관련 반응

26건

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