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

Systemtic Name: 3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanamide Openeye Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: 3-(3-methyl-2-oxo-1-benzimidazolyl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-2-thiazolyl]propanamide IUPAC Name: 3-(3-methyl-2-oxobenzimidazol-1-yl)-N-[4-methyl-5-(4-prop-2-enyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)-1,3-thiazol-2-yl]propanamide Traditional Name: N-[5-(4-allyl-5-thioxo-1H-1,2,4-triazol-3-yl)-4-methyl-thiazol-2-yl]-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C20H21N7O2S2 MolecularWeight: 455.55644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCN2C3=CC=CC=C3N(C2=O)C)C4=NNC(=S)N4CC=C

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCN2C3=CC=CC=C3N(C2=O)C)C4=NNC(=S)N4CC=C

InChI

InChI=1S/C20H21N7O2S2/c1-4-10-27-17(23-24-19(27)30)16-12(2)21-18(31-16)22-15(28)9-11-26-14-8-6-5-7-13(14)25(3)20(26)29/h4-8H,1,9-11H2,2-3H3,(H,24,30)(H,21,22,28)