N-(4-methoxyphenyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(4-methoxyphenyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Openeye Name: N-(4-methoxyphenyl)-5-[(3-nitro-2-pyridyl)sulfanyl]-1,3,4-thiadiazol-2-amine CAS Name: N-(4-methoxyphenyl)-5-[(3-nitro-2-pyridinyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(4-methoxyphenyl)-5-(3-nitropyridin-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine Traditional Name: (4-methoxyphenyl)-[5-[(3-nitro-2-pyridyl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C14H11N5O3S2 MolecularWeight: 361.39884

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2=NN=C(S2)SC3=C(C=CC=N3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC2=NN=C(S2)SC3=C(C=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O3S2/c1-22-10-6-4-9(5-7-10)16-13-17-18-14(24-13)23-12-11(19(20)21)3-2-8-15-12/h2-8H,1H3,(H,16,17)