4-[2-benzamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-[2-benzamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Openeye Name: 4-[2-benzamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide CAS Name: 4-[2-benzamido-4-[oxo-[(2-phenylcyclopropyl)amino]methyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-[2-benzamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Traditional Name: 4-[2-benzamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-N-ethyl-1,4-diazepane-1-carboxamide Formula: C31H35N5O3 MolecularWeight: 525.6413

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)N1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3CC3C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

Isomeric SMILES

CCNC(=O)N1CCCN(CC1)C2=C(C=C(C=C2)C(=O)NC3CC3C4=CC=CC=C4)NC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H35N5O3/c1-2-32-31(39)36-17-9-16-35(18-19-36)28-15-14-24(20-27(28)34-29(37)23-12-7-4-8-13-23)30(38)33-26-21-25(26)22-10-5-3-6-11-22/h3-8,10-15,20,25-26H,2,9,16-19,21H2,1H3,(H,32,39)(H,33,38)(H,34,37)