N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide

Systemtic Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanyl-butanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-phenylsulfanyl-butanamide CAS Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-4-(phenylthio)butanamide IUPAC Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-phenylsulfanylbutanamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-(phenylthio)butyramide Formula: C19H21N5OS3 MolecularWeight: 431.59794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCCSC2=CC=CC=C2)C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCCSC2=CC=CC=C2)C3=NNC(=S)N3CC=C

InChI

InChI=1S/C19H21N5OS3/c1-3-11-24-17(22-23-19(24)26)16-13(2)20-18(28-16)21-15(25)10-7-12-27-14-8-5-4-6-9-14/h3-6,8-9H,1,7,10-12H2,2H3,(H,23,26)(H,20,21,25)