N-(1-azanyl-3-phenyl-propan-2-yl)-5-(6-azanyl-1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide

Systemtic Name: N-(1-azanyl-3-phenyl-propan-2-yl)-5-(6-azanyl-1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Openeye Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-5-(6-amino-1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide CAS Name: N-(1-amino-3-phenylpropan-2-yl)-5-(6-amino-1H-pyrrolo[2,3-b]pyridin-4-yl)-2-thiophenecarboxamide IUPAC Name: N-(1-amino-3-phenylpropan-2-yl)-5-(6-amino-1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Traditional Name: N-[1-(aminomethyl)-2-phenyl-ethyl]-5-(6-amino-1H-pyrrolo[2,3-b]pyridin-4-yl)thiophene-2-carboxamide Formula: C21H21N5OS MolecularWeight: 391.48934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(CN)NC(=O)C2=CC=C(S2)C3=CC(=NC4=C3C=CN4)N

Isomeric SMILES

C1=CC=C(C=C1)CC(CN)NC(=O)C2=CC=C(S2)C3=CC(=NC4=C3C=CN4)N

InChI

InChI=1S/C21H21N5OS/c22-12-14(10-13-4-2-1-3-5-13)25-21(27)18-7-6-17(28-18)16-11-19(23)26-20-15(16)8-9-24-20/h1-9,11,14H,10,12,22H2,(H,25,27)(H3,23,24,26)