1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one

Systemtic Name: 1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one Openeye Name: 1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one CAS Name: 1-(9-carbazolyl)-2-(1H-1,2,4-triazol-5-ylthio)-1-butanone IUPAC Name: 1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylsulfanyl)butan-1-one Traditional Name: 1-carbazol-9-yl-2-(1H-1,2,4-triazol-5-ylthio)butan-1-one Formula: C18H16N4OS MolecularWeight: 336.41084

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=NC=NN4

Isomeric SMILES

CCC(C(=O)N1C2=CC=CC=C2C3=CC=CC=C31)SC4=NC=NN4

InChI

InChI=1S/C18H16N4OS/c1-2-16(24-18-19-11-20-21-18)17(23)22-14-9-5-3-7-12(14)13-8-4-6-10-15(13)22/h3-11,16H,2H2,1H3,(H,19,20,21)