4-[2-[(3-chlorophenyl)carbonylamino]-4-(cyclopropylmethylcarbamoyl)phenyl]-N-ethyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-[(3-chlorophenyl)carbonylamino]-4-(cyclopropylmethylcarbamoyl)phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Openeye Name: 4-[2-[(3-chlorobenzoyl)amino]-4-(cyclopropylmethylcarbamoyl)phenyl]-N-ethyl-1,4-diazepane-1-carboxamide CAS Name: 4-[2-[[(3-chlorophenyl)-oxomethyl]amino]-4-[(cyclopropylmethylamino)-oxomethyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-[2-[(3-chlorobenzoyl)amino]-4-(cyclopropylmethylcarbamoyl)phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Traditional Name: 4-[2-[(3-chlorobenzoyl)amino]-4-(cyclopropylmethylcarbamoyl)phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Formula: C26H32ClN5O3 MolecularWeight: 498.01698

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3CC3)NC(=O)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCNC(=O)N1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NCC3CC3)NC(=O)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C26H32ClN5O3/c1-2-28-26(35)32-12-4-11-31(13-14-32)23-10-9-20(24(33)29-17-18-7-8-18)16-22(23)30-25(34)19-5-3-6-21(27)15-19/h3,5-6,9-10,15-16,18H,2,4,7-8,11-14,17H2,1H3,(H,28,35)(H,29,33)(H,30,34)