4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide

Systemtic Name: 4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Openeye Name: 4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide CAS Name: 4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide IUPAC Name: 4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitrobenzamide Traditional Name: 4-(dimethylamino)-N-(5-methyl-1,3,4-thiadiazol-2-yl)-3-nitro-benzamide Formula: C12H13N5O3S MolecularWeight: 307.32832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=NN=C(S1)NC(=O)C2=CC(=C(C=C2)N(C)C)[N+](=O)[O-]

InChI

InChI=1S/C12H13N5O3S/c1-7-14-15-12(21-7)13-11(18)8-4-5-9(16(2)3)10(6-8)17(19)20/h4-6H,1-3H3,(H,13,15,18)