S-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl] benzenecarbothioate

Systemtic Name: S-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl] benzenecarbothioate Openeye Name: S-[5-(5-nitrothiazol-2-yl)sulfanyl-1,3,4-thiadiazol-2-yl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[5-[(5-nitro-2-thiazolyl)thio]-1,3,4-thiadiazol-2-yl] ester IUPAC Name: S-[5-[(5-nitro-1,3-thiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[5-[(5-nitrothiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl] ester Formula: C12H6N4O3S4 MolecularWeight: 382.46104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)SC2=NN=C(S2)SC3=NC=C(S3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)SC2=NN=C(S2)SC3=NC=C(S3)[N+](=O)[O-]

InChI

InChI=1S/C12H6N4O3S4/c17-9(7-4-2-1-3-5-7)21-11-14-15-12(23-11)22-10-13-6-8(20-10)16(18)19/h1-6H