N-(5-methyl-1,3-thiazol-2-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(5-methyl-1,3-thiazol-2-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(5-methylthiazol-2-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(5-methyl-2-thiazolyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(5-methyl-1,3-thiazol-2-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(5-methylthiazol-2-yl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C13H10N6O3S MolecularWeight: 330.3219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(S1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CC1=CN=C(S1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O3S/c1-8-5-15-13(23-8)17-12(20)9-2-3-10(11(4-9)19(21)22)18-7-14-6-16-18/h2-7H,1H3,(H,15,17,20)