N-methyl-N-[(4-methylphenyl)methyl]-4-[(5E)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide

Systemtic Name: N-methyl-N-[(4-methylphenyl)methyl]-4-[(5E)-4-oxidanylidene-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide Openeye Name: N-methyl-4-[(5E)-4-oxo-5-(2-thienylmethylene)-2-thioxo-thiazolidin-3-yl]-N-(p-tolylmethyl)butanamide CAS Name: N-methyl-N-[(4-methylphenyl)methyl]-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-3-thiazolidinyl]butanamide IUPAC Name: N-methyl-N-[(4-methylphenyl)methyl]-4-[(5E)-4-oxo-2-sulfanylidene-5-(thiophen-2-ylmethylidene)-1,3-thiazolidin-3-yl]butanamide Traditional Name: 4-[(5E)-4-keto-5-(2-thenylidene)-2-thioxo-thiazolidin-3-yl]-N-methyl-N-(4-methylbenzyl)butyramide Formula: C21H22N2O2S3 MolecularWeight: 430.60658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN(C)C(=O)CCCN2C(=O)C(=CC3=CC=CS3)SC2=S

Isomeric SMILES

CC1=CC=C(C=C1)CN(C)C(=O)CCCN2C(=O)/C(=C\C3=CC=CS3)/SC2=S

InChI

InChI=1S/C21H22N2O2S3/c1-15-7-9-16(10-8-15)14-22(2)19(24)6-3-11-23-20(25)18(28-21(23)26)13-17-5-4-12-27-17/h4-5,7-10,12-13H,3,6,11,14H2,1-2H3/b18-13+