3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: 3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: 3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butanamide CAS Name: 3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: 3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: 3-methyl-N-[5-(4-nitrophenyl)-1,3,4-thiadiazol-2-yl]butyramide Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=NN=C(S1)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)CC(=O)NC1=NN=C(S1)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H14N4O3S/c1-8(2)7-11(18)14-13-16-15-12(21-13)9-3-5-10(6-4-9)17(19)20/h3-6,8H,7H2,1-2H3,(H,14,16,18)