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

Systemtic Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide Openeye Name: 4-(4-methylthiazol-2-yl)sulfanyl-3-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide CAS Name: 4-[(4-methyl-2-thiazolyl)thio]-3-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide IUPAC Name: 4-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-3-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide Traditional Name: 4-[(4-methylthiazol-2-yl)thio]-3-nitro-N-(1H-1,2,4-triazol-5-yl)benzamide Formula: C13H10N6O3S2 MolecularWeight: 362.3869

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC=NN3)[N+](=O)[O-]

Isomeric SMILES

CC1=CSC(=N1)SC2=C(C=C(C=C2)C(=O)NC3=NC=NN3)[N+](=O)[O-]

InChI

InChI=1S/C13H10N6O3S2/c1-7-5-23-13(16-7)24-10-3-2-8(4-9(10)19(21)22)11(20)17-12-14-6-15-18-12/h2-6H,1H3,(H2,14,15,17,18,20)