(3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-1-phenyl-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-oxo-1-phenylpyrrolidine-3-carboxamide Traditional Name: (3S)-N-(6-ethoxy-1,3-benzothiazol-2-yl)-5-keto-1-phenyl-pyrrolidine-3-carboxamide Formula: C20H19N3O3S MolecularWeight: 381.44816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CC(=O)N(C3)C4=CC=CC=C4

InChI

InChI=1S/C20H19N3O3S/c1-2-26-15-8-9-16-17(11-15)27-20(21-16)22-19(25)13-10-18(24)23(12-13)14-6-4-3-5-7-14/h3-9,11,13H,2,10,12H2,1H3,(H,21,22,25)/t13-/m0/s1