N-(2,4-dimethylphenyl)-5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine

Systemtic Name: N-(2,4-dimethylphenyl)-5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine Openeye Name: N-(2,4-dimethylphenyl)-5-(5-nitrothiazol-2-yl)sulfanyl-1,3,4-thiadiazol-2-amine CAS Name: N-(2,4-dimethylphenyl)-5-[(5-nitro-2-thiazolyl)thio]-1,3,4-thiadiazol-2-amine IUPAC Name: N-(2,4-dimethylphenyl)-5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-amine Traditional Name: (2,4-dimethylphenyl)-[5-[(5-nitrothiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]amine Formula: C13H11N5O2S3 MolecularWeight: 365.45374

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC2=NN=C(S2)SC3=NC=C(S3)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC2=NN=C(S2)SC3=NC=C(S3)[N+](=O)[O-])C

InChI

InChI=1S/C13H11N5O2S3/c1-7-3-4-9(8(2)5-7)15-11-16-17-13(22-11)23-12-14-6-10(21-12)18(19)20/h3-6H,1-2H3,(H,15,16)