4-(1-azanylethyl)-N3-methyl-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide

Systemtic Name: 4-(1-azanylethyl)-N3-methyl-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide Openeye Name: 4-(1-aminoethyl)-N3-methyl-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide CAS Name: 4-(1-aminoethyl)-N3-methyl-N1-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide IUPAC Name: 4-(1-aminoethyl)-3-N-methyl-1-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)benzene-1,3-dicarboxamide Traditional Name: 4-(1-aminoethyl)-N'-methyl-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)isophthalamide Formula: C18H19N5O2 MolecularWeight: 337.37576

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C(=O)NC)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C(=O)NC)N

InChI

InChI=1S/C18H19N5O2/c1-10(19)12-4-3-11(9-14(12)18(25)20-2)17(24)23-15-6-8-22-16-13(15)5-7-21-16/h3-10H,19H2,1-2H3,(H,20,25)(H2,21,22,23,24)