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

Systemtic Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloranyl-pyridine-3-carboxamide Openeye Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-methyl-phenyl]-6-chloro-pyridine-3-carboxamide CAS Name: N-[4-[[[4-(aminomethyl)phenyl]methylamino]-oxomethyl]-2-methylphenyl]-6-chloro-3-pyridinecarboxamide IUPAC Name: N-[4-[[4-(aminomethyl)phenyl]methylcarbamoyl]-2-methylphenyl]-6-chloropyridine-3-carboxamide Traditional Name: N-[4-[[4-(aminomethyl)benzyl]carbamoyl]-2-methyl-phenyl]-6-chloro-nicotinamide Formula: C22H21ClN4O2 MolecularWeight: 408.88074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN)NC(=O)C3=CN=C(C=C3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN)NC(=O)C3=CN=C(C=C3)Cl

InChI

InChI=1S/C22H21ClN4O2/c1-14-10-17(21(28)26-12-16-4-2-15(11-24)3-5-16)6-8-19(14)27-22(29)18-7-9-20(23)25-13-18/h2-10,13H,11-12,24H2,1H3,(H,26,28)(H,27,29)