5-(azepan-1-ylsulfonyl)-N-[2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-ethyl-2-methoxy-benzamide

Systemtic Name: 5-(azepan-1-ylsulfonyl)-N-[2-[(5-chloranyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-N-ethyl-2-methoxy-benzamide Openeye Name: 5-(azepan-1-ylsulfonyl)-N-[2-(5-chloro-2-methyl-anilino)-2-oxo-ethyl]-N-ethyl-2-methoxy-benzamide CAS Name: 5-(1-azepanylsulfonyl)-N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-2-methoxybenzamide IUPAC Name: 5-(azepan-1-ylsulfonyl)-N-[2-(5-chloro-2-methylanilino)-2-oxoethyl]-N-ethyl-2-methoxybenzamide Traditional Name: 5-(azepan-1-ylsulfonyl)-N-[2-(5-chloro-2-methyl-anilino)-2-keto-ethyl]-N-ethyl-2-methoxy-benzamide Formula: C25H32ClN3O5S MolecularWeight: 522.05668

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCN(CC(=O)NC1=C(C=CC(=C1)Cl)C)C(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C25H32ClN3O5S/c1-4-28(17-24(30)27-22-15-19(26)10-9-18(22)2)25(31)21-16-20(11-12-23(21)34-3)35(32,33)29-13-7-5-6-8-14-29/h9-12,15-16H,4-8,13-14,17H2,1-3H3,(H,27,30)