4-methoxy-N-[(2S)-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzenesulfonamide

Systemtic Name: 4-methoxy-N-[(2S)-1-oxidanylidene-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzenesulfonamide Openeye Name: 4-methoxy-N-[(1S)-1-methyl-2-oxo-2-[4-(2-thienylmethyl)-1,4-diazepan-1-yl]ethyl]benzenesulfonamide CAS Name: 4-methoxy-N-[(2S)-1-oxo-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzenesulfonamide IUPAC Name: 4-methoxy-N-[(2S)-1-oxo-1-[4-(thiophen-2-ylmethyl)-1,4-diazepan-1-yl]propan-2-yl]benzenesulfonamide Traditional Name: N-[(1S)-2-keto-1-methyl-2-[4-(2-thenyl)-1,4-diazepan-1-yl]ethyl]-4-methoxy-benzenesulfonamide Formula: C20H27N3O4S2 MolecularWeight: 437.57608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCN(CC1)CC2=CC=CS2)NS(=O)(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

C[C@@H](C(=O)N1CCCN(CC1)CC2=CC=CS2)NS(=O)(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H27N3O4S2/c1-16(21-29(25,26)19-8-6-17(27-2)7-9-19)20(24)23-11-4-10-22(12-13-23)15-18-5-3-14-28-18/h3,5-9,14,16,21H,4,10-13,15H2,1-2H3/t16-/m0/s1