(3S)-N-benzo[e][1,3]benzothiazol-2-yl-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-N-benzo[e][1,3]benzothiazol-2-yl-1-cyclopentyl-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-N-benzo[e][1,3]benzothiazol-2-yl-1-cyclopentyl-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-N-(2-benzo[e][1,3]benzothiazolyl)-1-cyclopentyl-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-N-benzo[e][1,3]benzothiazol-2-yl-1-cyclopentyl-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-N-benzo[e][1,3]benzothiazol-2-yl-1-cyclopentyl-5-keto-pyrrolidine-3-carboxamide Formula: C21H21N3O2S MolecularWeight: 379.47534

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)N2CC(CC2=O)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

Isomeric SMILES

C1CCC(C1)N2C[C@H](CC2=O)C(=O)NC3=NC4=C(S3)C=CC5=CC=CC=C54

InChI

InChI=1S/C21H21N3O2S/c25-18-11-14(12-24(18)15-6-2-3-7-15)20(26)23-21-22-19-16-8-4-1-5-13(16)9-10-17(19)27-21/h1,4-5,8-10,14-15H,2-3,6-7,11-12H2,(H,22,23,26)/t14-/m0/s1