4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-(3-cyclopentyloxy-4-methoxy-phenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-[(2-chlorophenyl)amino]-2-oxidanylidene-ethyl]-N-(3-cyclopentyloxy-4-methoxy-phenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-[2-(2-chloroanilino)-2-oxo-ethyl]-N-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,4-diazepane-1-carboxamide CAS Name: 4-[2-(2-chloroanilino)-2-oxoethyl]-N-(3-cyclopentyloxy-4-methoxyphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-[2-(2-chloroanilino)-2-oxoethyl]-N-(3-cyclopentyloxy-4-methoxyphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-[2-(2-chloroanilino)-2-keto-ethyl]-N-[3-(cyclopentoxy)-4-methoxy-phenyl]-1,4-diazepane-1-carboxamide Formula: C26H33ClN4O4 MolecularWeight: 501.01762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC=C3Cl)OC4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)N2CCCN(CC2)CC(=O)NC3=CC=CC=C3Cl)OC4CCCC4

InChI

InChI=1S/C26H33ClN4O4/c1-34-23-12-11-19(17-24(23)35-20-7-2-3-8-20)28-26(33)31-14-6-13-30(15-16-31)18-25(32)29-22-10-5-4-9-21(22)27/h4-5,9-12,17,20H,2-3,6-8,13-16,18H2,1H3,(H,28,33)(H,29,32)