N-[(3-methylthiophen-2-yl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-[(3-methylthiophen-2-yl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-[(3-methyl-2-thienyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-[(3-methyl-2-thiophenyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-[(3-methylthiophen-2-yl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-[(3-methyl-2-thienyl)methyl]-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C15H13N5O3S MolecularWeight: 343.36042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(SC=C1)CNC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C15H13N5O3S/c1-10-4-5-24-14(10)7-17-15(21)11-2-3-12(13(6-11)20(22)23)19-9-16-8-18-19/h2-6,8-9H,7H2,1H3,(H,17,21)