1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(3-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide

Systemtic Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(3-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Openeye Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(3-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide CAS Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-[3-(1-pyrrolyl)phenyl]ethyl]-3-pyrazolecarboxamide IUPAC Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(3-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Traditional Name: 1-[(3-nitro-1,2,4-triazol-1-yl)methyl]-N-[1-(3-pyrrol-1-ylphenyl)ethyl]pyrazole-3-carboxamide Formula: C19H18N8O3 MolecularWeight: 406.39802

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)N2C=CC=C2)NC(=O)C3=NN(C=C3)CN4C=NC(=N4)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC(=CC=C1)N2C=CC=C2)NC(=O)C3=NN(C=C3)CN4C=NC(=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H18N8O3/c1-14(15-5-4-6-16(11-15)24-8-2-3-9-24)21-18(28)17-7-10-25(22-17)13-26-12-20-19(23-26)27(29)30/h2-12,14H,13H2,1H3,(H,21,28)