N-[4-(azepan-1-yl)-3-[(3-bromophenyl)carbamoylamino]phenyl]benzamide

Systemtic Name: N-[4-(azepan-1-yl)-3-[(3-bromophenyl)carbamoylamino]phenyl]benzamide Openeye Name: N-[4-(azepan-1-yl)-3-[(3-bromophenyl)carbamoylamino]phenyl]benzamide CAS Name: N-[4-(1-azepanyl)-3-[[(3-bromoanilino)-oxomethyl]amino]phenyl]benzamide IUPAC Name: N-[4-(azepan-1-yl)-3-[(3-bromophenyl)carbamoylamino]phenyl]benzamide Traditional Name: N-[4-(azepan-1-yl)-3-[(3-bromophenyl)carbamoylamino]phenyl]benzamide Formula: C26H27BrN4O2 MolecularWeight: 507.42218

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)NC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

C1CCCN(CC1)C2=C(C=C(C=C2)NC(=O)C3=CC=CC=C3)NC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C26H27BrN4O2/c27-20-11-8-12-21(17-20)29-26(33)30-23-18-22(28-25(32)19-9-4-3-5-10-19)13-14-24(23)31-15-6-1-2-7-16-31/h3-5,8-14,17-18H,1-2,6-7,15-16H2,(H,28,32)(H2,29,30,33)