5-(azepan-1-ylsulfonyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-ethyl-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]-N-ethyl-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl]-N-ethyl-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-ethyl-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-N-ethyl-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(4-chlorobenzyl)amino]-2-keto-ethyl]-N-ethyl-2-methoxy-benzamide Formula: C25H32ClN3O5S MolecularWeight: 522.05668

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCN(CC(=O)NCC1=CC=C(C=C1)Cl)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C25H32ClN3O5S/c1-3-28(18-24(30)27-17-19-8-10-20(26)11-9-19)25(31)22-16-21(12-13-23(22)34-2)35(32,33)29-14-6-4-5-7-15-29/h8-13,16H,3-7,14-15,17-18H2,1-2H3,(H,27,30)