(2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile

Systemtic Name: (2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxidanylidene-butanenitrile Openeye Name: (2Z)-4-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-2-(3-methyl-1,3-benzothiazol-2-ylidene)-3-oxo-butanenitrile CAS Name: (2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)thio]-3-oxobutanenitrile IUPAC Name: (2Z)-2-(3-methyl-1,3-benzothiazol-2-ylidene)-4-[(5-methyl-4-prop-2-enyl-1,2,4-triazol-3-yl)sulfanyl]-3-oxobutanenitrile Traditional Name: (2Z)-4-[(4-allyl-5-methyl-1,2,4-triazol-3-yl)thio]-3-keto-2-(3-methyl-1,3-benzothiazol-2-ylidene)butyronitrile Formula: C18H17N5OS2 MolecularWeight: 383.49048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CC=C)SCC(=O)C(=C2N(C3=CC=CC=C3S2)C)C#N

Isomeric SMILES

CC1=NN=C(N1CC=C)SCC(=O)/C(=C\2/N(C3=CC=CC=C3S2)C)/C#N

InChI

InChI=1S/C18H17N5OS2/c1-4-9-23-12(2)20-21-18(23)25-11-15(24)13(10-19)17-22(3)14-7-5-6-8-16(14)26-17/h4-8H,1,9,11H2,2-3H3/b17-13-