3-(azepan-1-ylmethyl)-N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]benzamide

Systemtic Name: 3-(azepan-1-ylmethyl)-N-[1,1-bis(oxidanylidene)-2,3-dihydrothiophen-3-yl]benzamide Openeye Name: 3-(azepan-1-ylmethyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)benzamide CAS Name: 3-(1-azepanylmethyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)benzamide IUPAC Name: 3-(azepan-1-ylmethyl)-N-(1,1-dioxo-2,3-dihydrothiophen-3-yl)benzamide Traditional Name: 3-(azepan-1-ylmethyl)-N-(1,1-diketo-2,3-dihydrothiophen-3-yl)benzamide Formula: C18H24N2O3S MolecularWeight: 348.45976

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=CC(=C2)C(=O)NC3CS(=O)(=O)C=C3

Isomeric SMILES

C1CCCN(CC1)CC2=CC=CC(=C2)C(=O)NC3CS(=O)(=O)C=C3

InChI

InChI=1S/C18H24N2O3S/c21-18(19-17-8-11-24(22,23)14-17)16-7-5-6-15(12-16)13-20-9-3-1-2-4-10-20/h5-8,11-12,17H,1-4,9-10,13-14H2,(H,19,21)