5-(azepan-1-ylsulfonyl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[(2S)-1-(ethylamino)-1-oxidanylidene-propan-2-yl]-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[(1S)-2-(ethylamino)-1-methyl-2-oxo-ethyl]-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[(2S)-1-(ethylamino)-1-oxopropan-2-yl]-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[(1S)-2-(ethylamino)-2-keto-1-methyl-ethyl]-2-methoxy-benzamide Formula: C19H29N3O5S MolecularWeight: 411.51566

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

Isomeric SMILES

CCNC(=O)[C@H](C)NC(=O)C1=C(C=CC(=C1)S(=O)(=O)N2CCCCCC2)OC

InChI

InChI=1S/C19H29N3O5S/c1-4-20-18(23)14(2)21-19(24)16-13-15(9-10-17(16)27-3)28(25,26)22-11-7-5-6-8-12-22/h9-10,13-14H,4-8,11-12H2,1-3H3,(H,20,23)(H,21,24)/t14-/m0/s1