1-[[3-(aminomethyl)phenyl]amino]-3-(3-chloranyl-4-piperidin-1-yl-phenyl)-1-phenyl-urea

Systemtic Name: 1-[[3-(aminomethyl)phenyl]amino]-3-(3-chloranyl-4-piperidin-1-yl-phenyl)-1-phenyl-urea Openeye Name: 1-[3-(aminomethyl)anilino]-3-[3-chloro-4-(1-piperidyl)phenyl]-1-phenyl-urea CAS Name: 1-[3-(aminomethyl)anilino]-3-[3-chloro-4-(1-piperidinyl)phenyl]-1-phenylurea IUPAC Name: 1-[3-(aminomethyl)anilino]-3-(3-chloro-4-piperidin-1-ylphenyl)-1-phenylurea Traditional Name: 1-[3-(aminomethyl)anilino]-3-(3-chloro-4-piperidino-phenyl)-1-phenyl-urea Formula: C25H28ClN5O MolecularWeight: 449.97572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC4=CC=CC(=C4)CN)Cl

Isomeric SMILES

C1CCN(CC1)C2=C(C=C(C=C2)NC(=O)N(C3=CC=CC=C3)NC4=CC=CC(=C4)CN)Cl

InChI

InChI=1S/C25H28ClN5O/c26-23-17-20(12-13-24(23)30-14-5-2-6-15-30)28-25(32)31(22-10-3-1-4-11-22)29-21-9-7-8-19(16-21)18-27/h1,3-4,7-13,16-17,29H,2,5-6,14-15,18,27H2,(H,28,32)