N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,4-diazepane-1-carboxamide

Systemtic Name: N-(3-cyclopentyloxy-4-methoxy-phenyl)-4-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-1,4-diazepane-1-carboxamide Openeye Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-1,4-diazepane-1-carboxamide CAS Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(3-cyclopentyloxy-4-methoxyphenyl)-4-[2-(2,6-dimethylanilino)-2-oxoethyl]-1,4-diazepane-1-carboxamide Traditional Name: N-[3-(cyclopentoxy)-4-methoxy-phenyl]-4-[2-(2,6-dimethylanilino)-2-keto-ethyl]-1,4-diazepane-1-carboxamide Formula: C28H38N4O4 MolecularWeight: 494.62572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCCN(CC2)C(=O)NC3=CC(=C(C=C3)OC)OC4CCCC4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCCN(CC2)C(=O)NC3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C28H38N4O4/c1-20-8-6-9-21(2)27(20)30-26(33)19-31-14-7-15-32(17-16-31)28(34)29-22-12-13-24(35-3)25(18-22)36-23-10-4-5-11-23/h6,8-9,12-13,18,23H,4-5,7,10-11,14-17,19H2,1-3H3,(H,29,34)(H,30,33)