S-(1H-1,2,4-triazol-5-ylmethyl) phenothiazine-10-carbothioate

Systemtic Name: S-(1H-1,2,4-triazol-5-ylmethyl) phenothiazine-10-carbothioate Openeye Name: S-(1H-1,2,4-triazol-5-ylmethyl) phenothiazine-10-carbothioate CAS Name: 10-phenothiazinecarbothioic acid S-(1H-1,2,4-triazol-5-ylmethyl) ester IUPAC Name: S-(1H-1,2,4-triazol-5-ylmethyl) phenothiazine-10-carbothioate Traditional Name: phenothiazine-10-carbothioic acid S-(1H-1,2,4-triazol-5-ylmethyl) ester Formula: C16H12N4OS2 MolecularWeight: 340.42268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)SCC4=NC=NN4

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)SCC4=NC=NN4

InChI

InChI=1S/C16H12N4OS2/c21-16(22-9-15-17-10-18-19-15)20-11-5-1-3-7-13(11)23-14-8-4-2-6-12(14)20/h1-8,10H,9H2,(H,17,18,19)