N-[5-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-chloranyl-phenyl]-6-chloranyl-pyridine-3-carboxamide

Systemtic Name: N-[5-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-chloranyl-phenyl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[5-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-chloro-phenyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[5-[[[4-(aminomethyl)phenyl]methylamino]-oxomethyl]-2-chlorophenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[5-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-chlorophenyl]-6-chloropyridine-3-carboxamide Traditional Name: N-[5-[[4-(aminomethyl)benzyl]carbamoyl]-2-chloro-phenyl]-6-chloro-nicotinamide Formula: C21H18Cl2N4O2 MolecularWeight: 429.29922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN)CNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

C1=CC(=CC=C1CN)CNC(=O)C2=CC(=C(C=C2)Cl)NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C21H18Cl2N4O2/c22-17-7-5-15(20(28)26-11-14-3-1-13(10-24)2-4-14)9-18(17)27-21(29)16-6-8-19(23)25-12-16/h1-9,12H,10-11,24H2,(H,26,28)(H,27,29)