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

Systemtic Name: N-ethyl-4-[4-[(2-phenylcyclopropyl)carbamoyl]-2-(pyridin-4-ylcarbonylamino)phenyl]-1,4-diazepane-1-carboxamide Openeye Name: N-ethyl-4-[4-[(2-phenylcyclopropyl)carbamoyl]-2-(pyridine-4-carbonylamino)phenyl]-1,4-diazepane-1-carboxamide CAS Name: N-ethyl-4-[4-[oxo-[(2-phenylcyclopropyl)amino]methyl]-2-[[oxo(pyridin-4-yl)methyl]amino]phenyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-ethyl-4-[4-[(2-phenylcyclopropyl)carbamoyl]-2-(pyridine-4-carbonylamino)phenyl]-1,4-diazepane-1-carboxamide Traditional Name: N-ethyl-4-[2-isonicotinamido-4-[(2-phenylcyclopropyl)carbamoyl]phenyl]-1,4-diazepane-1-carboxamide Formula: C30H34N6O3 MolecularWeight: 526.62936

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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=NC=C5

Isomeric SMILES

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

InChI

InChI=1S/C30H34N6O3/c1-2-32-30(39)36-16-6-15-35(17-18-36)27-10-9-23(19-26(27)34-28(37)22-11-13-31-14-12-22)29(38)33-25-20-24(25)21-7-4-3-5-8-21/h3-5,7-14,19,24-25H,2,6,15-18,20H2,1H3,(H,32,39)(H,33,38)(H,34,37)