(3S)-1-[(2-chlorophenyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide

Systemtic Name: (3S)-1-[(2-chlorophenyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxidanylidene-pyrrolidine-3-carboxamide Openeye Name: (3S)-1-[(2-chlorophenyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-pyrrolidine-3-carboxamide CAS Name: (3S)-1-[(2-chlorophenyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxo-3-pyrrolidinecarboxamide IUPAC Name: (3S)-1-[(2-chlorophenyl)methyl]-N-(6-methoxy-1,3-benzothiazol-2-yl)-5-oxopyrrolidine-3-carboxamide Traditional Name: (3S)-1-(2-chlorobenzyl)-5-keto-N-(6-methoxy-1,3-benzothiazol-2-yl)pyrrolidine-3-carboxamide Formula: C20H18ClN3O3S MolecularWeight: 415.89322

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC(=O)N(C3)CC4=CC=CC=C4Cl

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)NC(=O)[C@H]3CC(=O)N(C3)CC4=CC=CC=C4Cl

InChI

InChI=1S/C20H18ClN3O3S/c1-27-14-6-7-16-17(9-14)28-20(22-16)23-19(26)13-8-18(25)24(11-13)10-12-4-2-3-5-15(12)21/h2-7,9,13H,8,10-11H2,1H3,(H,22,23,26)/t13-/m0/s1