4-(1-azanylethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-thiophen-2-yl-benzamide

Systemtic Name: 4-(1-azanylethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-thiophen-2-yl-benzamide Openeye Name: 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-(2-thienyl)benzamide CAS Name: 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-thiophen-2-ylbenzamide IUPAC Name: 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-thiophen-2-ylbenzamide Traditional Name: 4-(1-aminoethyl)-N-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-(2-thienyl)benzamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C4=CC=CS4)N

Isomeric SMILES

CC(C1=C(C=C(C=C1)C(=O)NC2=C3C=CNC3=NC=C2)C4=CC=CS4)N

InChI

InChI=1S/C20H18N4OS/c1-12(21)14-5-4-13(11-16(14)18-3-2-10-26-18)20(25)24-17-7-9-23-19-15(17)6-8-22-19/h2-12H,21H2,1H3,(H2,22,23,24,25)