3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxo-2-pyrrolidin-1-yl-ethyl)benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-methoxy-N-[2-oxo-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-methoxy-N-(2-oxo-2-pyrrolidin-1-ylethyl)benzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-N-(2-keto-2-pyrrolidino-ethyl)-4-methoxy-benzamide Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCCC2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)N2CCCC2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C20H29N3O5S/c1-28-17-9-8-16(20(25)21-15-19(24)22-10-6-7-11-22)14-18(17)29(26,27)23-12-4-2-3-5-13-23/h8-9,14H,2-7,10-13,15H2,1H3,(H,21,25)