1-(4-methylphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea

Systemtic Name: 1-(4-methylphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Openeye Name: 3-phenyl-1-(p-tolyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea CAS Name: 1-(4-methylphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea IUPAC Name: 1-(4-methylphenyl)-3-phenyl-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Traditional Name: 3-phenyl-1-(p-tolyl)-1-(3,4,5,6-tetrahydro-2H-azepin-7-yl)urea Formula: C20H23N3O MolecularWeight: 321.41612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N(C2=NCCCCC2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H23N3O/c1-16-11-13-18(14-12-16)23(19-10-6-3-7-15-21-19)20(24)22-17-8-4-2-5-9-17/h2,4-5,8-9,11-14H,3,6-7,10,15H2,1H3,(H,22,24)