S-(1H-1,2,4-triazol-5-ylmethyl) 1,2,3,4-tetrahydrocarbazole-9-carbothioate

Systemtic Name: S-(1H-1,2,4-triazol-5-ylmethyl) 1,2,3,4-tetrahydrocarbazole-9-carbothioate Openeye Name: S-(1H-1,2,4-triazol-5-ylmethyl) 1,2,3,4-tetrahydrocarbazole-9-carbothioate CAS Name: 1,2,3,4-tetrahydrocarbazole-9-carbothioic acid S-(1H-1,2,4-triazol-5-ylmethyl) ester IUPAC Name: S-(1H-1,2,4-triazol-5-ylmethyl) 1,2,3,4-tetrahydrocarbazole-9-carbothioate Traditional Name: 1,2,3,4-tetrahydrocarbazole-9-carbothioic acid S-(1H-1,2,4-triazol-5-ylmethyl) ester Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=CC=CC=C3N2C(=O)SCC4=NC=NN4

Isomeric SMILES

C1CCC2=C(C1)C3=CC=CC=C3N2C(=O)SCC4=NC=NN4

InChI

InChI=1S/C16H16N4OS/c21-16(22-9-15-17-10-18-19-15)20-13-7-3-1-5-11(13)12-6-2-4-8-14(12)20/h1,3,5,7,10H,2,4,6,8-9H2,(H,17,18,19)