4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(6-pyrrolidin-1-ylpyridin-3-yl)benzamide

Systemtic Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(6-pyrrolidin-1-ylpyridin-3-yl)benzamide Openeye Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(6-pyrrolidin-1-yl-3-pyridyl)benzamide CAS Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-N-[6-(1-pyrrolidinyl)-3-pyridinyl]benzamide IUPAC Name: 4-[(4-methyl-1,2,4-triazol-3-yl)sulfanyl]-3-nitro-N-(6-pyrrolidin-1-ylpyridin-3-yl)benzamide Traditional Name: 4-[(4-methyl-1,2,4-triazol-3-yl)thio]-3-nitro-N-(6-pyrrolidino-3-pyridyl)benzamide Formula: C19H19N7O3S MolecularWeight: 425.46426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)NC3=CN=C(C=C3)N4CCCC4)[N+](=O)[O-]

Isomeric SMILES

CN1C=NN=C1SC2=C(C=C(C=C2)C(=O)NC3=CN=C(C=C3)N4CCCC4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N7O3S/c1-24-12-21-23-19(24)30-16-6-4-13(10-15(16)26(28)29)18(27)22-14-5-7-17(20-11-14)25-8-2-3-9-25/h4-7,10-12H,2-3,8-9H2,1H3,(H,22,27)