N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]-4-oxidanylidene-4-thiophen-2-yl-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-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]-4-oxo-4-thiophen-2-ylbutanamide 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-oxo-4-thiophen-2-ylbutanamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-4-keto-4-(2-thienyl)butyramide Formula: C17H17N5O2S3 MolecularWeight: 419.54418

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCC(=O)C2=CC=CS2)C3=NNC(=S)N3CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCC(=O)C2=CC=CS2)C3=NNC(=S)N3CC=C

InChI

InChI=1S/C17H17N5O2S3/c1-3-8-22-15(20-21-17(22)25)14-10(2)18-16(27-14)19-13(24)7-6-11(23)12-5-4-9-26-12/h3-5,9H,1,6-8H2,2H3,(H,21,25)(H,18,19,24)