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

Systemtic Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-5-oxo-1-(p-tolyl)pyrrolidine-3-carboxamide CAS Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-1-(4-methylphenyl)-5-oxopyrrolidine-3-carboxamide Traditional Name: N-(6-ethyl-1,3-benzothiazol-2-yl)-5-keto-1-(p-tolyl)pyrrolidine-3-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)C4=CC=C(C=C4)C

InChI

InChI=1S/C21H21N3O2S/c1-3-14-6-9-17-18(10-14)27-21(22-17)23-20(26)15-11-19(25)24(12-15)16-7-4-13(2)5-8-16/h4-10,15H,3,11-12H2,1-2H3,(H,22,23,26)