1-[[1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]piperidin-3-yl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]piperidin-3-yl]methyl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[[1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]-3-piperidyl]methyl]urea CAS Name: 1-[[1-[[4-(3-phenyl-2-quinoxalinyl)phenyl]methyl]-3-piperidinyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[1-[[4-(3-phenylquinoxalin-2-yl)phenyl]methyl]piperidin-3-yl]methyl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[[1-[4-(3-phenylquinoxalin-2-yl)benzyl]-3-piperidyl]methyl]urea Formula: C31H35N5O MolecularWeight: 493.6425

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1CCCN(C1)CC2=CC=C(C=C2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5

Isomeric SMILES

CC(C)NC(=O)NCC1CCCN(C1)CC2=CC=C(C=C2)C3=NC4=CC=CC=C4N=C3C5=CC=CC=C5

InChI

InChI=1S/C31H35N5O/c1-22(2)33-31(37)32-19-24-9-8-18-36(21-24)20-23-14-16-26(17-15-23)30-29(25-10-4-3-5-11-25)34-27-12-6-7-13-28(27)35-30/h3-7,10-17,22,24H,8-9,18-21H2,1-2H3,(H2,32,33,37)