N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-acetamido-1,3-benzothiazol-2-yl)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)NC(=O)C

Isomeric SMILES

CC1=CC=C(C=C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=C(C=C4)NC(=O)C

InChI

InChI=1S/C21H20N4O3S/c1-12-3-6-16(7-4-12)25-11-14(9-19(25)27)20(28)24-21-23-17-8-5-15(22-13(2)26)10-18(17)29-21/h3-8,10,14H,9,11H2,1-2H3,(H,22,26)(H,23,24,28)