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

Systemtic Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chloranyl-phenyl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chloro-phenyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[4-[[[4-(aminomethyl)phenyl]methylamino]-oxomethyl]-3-chlorophenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-3-chlorophenyl]-6-chloropyridine-3-carboxamide Traditional Name: N-[4-[[4-(aminomethyl)benzyl]carbamoyl]-3-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=C(C=C(C=C2)NC(=O)C3=CN=C(C=C3)Cl)Cl

Isomeric SMILES

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

InChI

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