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

Systemtic Name: 1-[[3-(aminomethyl)phenyl]amino]-3-[4-(2-oxidanylidenepiperidin-1-yl)phenyl]-1-phenyl-urea Openeye Name: 1-[3-(aminomethyl)anilino]-3-[4-(2-oxo-1-piperidyl)phenyl]-1-phenyl-urea CAS Name: 1-[3-(aminomethyl)anilino]-3-[4-(2-oxo-1-piperidinyl)phenyl]-1-phenylurea IUPAC Name: 1-[3-(aminomethyl)anilino]-3-[4-(2-oxopiperidin-1-yl)phenyl]-1-phenylurea Traditional Name: 1-[3-(aminomethyl)anilino]-3-[4-(2-ketopiperidino)phenyl]-1-phenyl-urea Formula: C25H27N5O2 MolecularWeight: 429.51418

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(=O)C1)C2=CC=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC4=CC=CC(=C4)CN

Isomeric SMILES

C1CCN(C(=O)C1)C2=CC=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC4=CC=CC(=C4)CN

InChI

InChI=1S/C25H27N5O2/c26-18-19-7-6-8-21(17-19)28-30(23-9-2-1-3-10-23)25(32)27-20-12-14-22(15-13-20)29-16-5-4-11-24(29)31/h1-3,6-10,12-15,17,28H,4-5,11,16,18,26H2,(H,27,32)