1-[[3-(aminomethyl)phenyl]amino]-3-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-1-phenyl-urea

Systemtic Name: 1-[[3-(aminomethyl)phenyl]amino]-3-[3-methyl-4-(2-oxidanylidenepiperidin-1-yl)phenyl]-1-phenyl-urea Openeye Name: 1-[3-(aminomethyl)anilino]-3-[3-methyl-4-(2-oxo-1-piperidyl)phenyl]-1-phenyl-urea CAS Name: 1-[3-(aminomethyl)anilino]-3-[3-methyl-4-(2-oxo-1-piperidinyl)phenyl]-1-phenylurea IUPAC Name: 1-[3-(aminomethyl)anilino]-3-[3-methyl-4-(2-oxopiperidin-1-yl)phenyl]-1-phenylurea Traditional Name: 1-[3-(aminomethyl)anilino]-3-[4-(2-ketopiperidino)-3-methyl-phenyl]-1-phenyl-urea Formula: C26H29N5O2 MolecularWeight: 443.54076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)N(C2=CC=CC=C2)NC3=CC=CC(=C3)CN)N4CCCCC4=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)N(C2=CC=CC=C2)NC3=CC=CC(=C3)CN)N4CCCCC4=O

InChI

InChI=1S/C26H29N5O2/c1-19-16-21(13-14-24(19)30-15-6-5-12-25(30)32)28-26(33)31(23-10-3-2-4-11-23)29-22-9-7-8-20(17-22)18-27/h2-4,7-11,13-14,16-17,29H,5-6,12,15,18,27H2,1H3,(H,28,33)