N-(2-azanyl-1-phenyl-ethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-3-carboxamide

Systemtic Name: N-(2-azanyl-1-phenyl-ethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-3-carboxamide Openeye Name: N-(2-amino-1-phenyl-ethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-3-carboxamide CAS Name: N-(2-amino-1-phenylethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)-3-thiophenecarboxamide IUPAC Name: N-(2-amino-1-phenylethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-3-carboxamide Traditional Name: N-(2-amino-1-phenyl-ethyl)-5-(1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-3-carboxamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CN)NC(=O)C2=CSC(=C2)C3=C4C=CNC4=NC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(CN)NC(=O)C2=CSC(=C2)C3=C4C=CNC4=NC=C3

InChI

InChI=1S/C20H18N4OS/c21-11-17(13-4-2-1-3-5-13)24-20(25)14-10-18(26-12-14)15-6-8-22-19-16(15)7-9-23-19/h1-10,12,17H,11,21H2,(H,22,23)(H,24,25)