3-(3-nitrophenyl)sulfanyl-1H-pyrrolo[3,2-b]pyridine-2-carboxamide

Systemtic Name: 3-(3-nitrophenyl)sulfanyl-1H-pyrrolo[3,2-b]pyridine-2-carboxamide Openeye Name: 3-(3-nitrophenyl)sulfanyl-1H-pyrrolo[3,2-b]pyridine-2-carboxamide CAS Name: 3-[(3-nitrophenyl)thio]-1H-pyrrolo[3,2-b]pyridine-2-carboxamide IUPAC Name: 3-(3-nitrophenyl)sulfanyl-1H-pyrrolo[3,2-b]pyridine-2-carboxamide Traditional Name: 3-[(3-nitrophenyl)thio]-1H-pyrrolo[3,2-b]pyridine-2-carboxamide Formula: C14H10N4O3S MolecularWeight: 314.3192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)SC2=C(NC3=C2N=CC=C3)C(=O)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)SC2=C(NC3=C2N=CC=C3)C(=O)N)[N+](=O)[O-]

InChI

InChI=1S/C14H10N4O3S/c15-14(19)12-13(11-10(17-12)5-2-6-16-11)22-9-4-1-3-8(7-9)18(20)21/h1-7,17H,(H2,15,19)