5-[(3-methyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(phenylmethyl)pyrazol-3-yl]-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(3-methyl-4-nitro-pyrazol-1-yl)methyl]-N-[1-(phenylmethyl)pyrazol-3-yl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(1-benzylpyrazol-3-yl)-5-[(3-methyl-4-nitro-pyrazol-1-yl)methyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(3-methyl-4-nitro-1-pyrazolyl)methyl]-N-[1-(phenylmethyl)-3-pyrazolyl]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(1-benzylpyrazol-3-yl)-5-[(3-methyl-4-nitropyrazol-1-yl)methyl]-1,3,4-thiadiazol-2-amine Traditional Name: (1-benzylpyrazol-3-yl)-[5-[(3-methyl-4-nitro-pyrazol-1-yl)methyl]-1,3,4-thiadiazol-2-yl]amine Formula: C17H16N8O2S MolecularWeight: 396.42634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CC2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CC2=NN=C(S2)NC3=NN(C=C3)CC4=CC=CC=C4

InChI

InChI=1S/C17H16N8O2S/c1-12-14(25(26)27)10-24(21-12)11-16-19-20-17(28-16)18-15-7-8-23(22-15)9-13-5-3-2-4-6-13/h2-8,10H,9,11H2,1H3,(H,18,20,22)