4-[2-(3-indol-1-ylpropylamino)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate

Systemtic Name: 4-[2-(3-indol-1-ylpropylamino)-2-oxidanylidene-ethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Openeye Name: 4-[2-(3-indol-1-ylpropylamino)-2-oxo-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate CAS Name: 4-[2-[3-(1-indolyl)propylamino]-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate IUPAC Name: 4-[2-(3-indol-1-ylpropylamino)-2-oxoethyl]-5-thiophen-2-yl-1,2,4-triazole-3-thiolate Traditional Name: 4-[2-(3-indol-1-ylpropylamino)-2-keto-ethyl]-5-(2-thienyl)-1,2,4-triazole-3-thiolate Formula: C19H18N5OS2- MolecularWeight: 396.50912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CN2CCCNC(=O)CN3C(=NN=C3[S-])C4=CC=CS4

Isomeric SMILES

C1=CC=C2C(=C1)C=CN2CCCNC(=O)CN3C(=NN=C3[S-])C4=CC=CS4

InChI

InChI=1S/C19H19N5OS2/c25-17(13-24-18(21-22-19(24)26)16-7-3-12-27-16)20-9-4-10-23-11-8-14-5-1-2-6-15(14)23/h1-3,5-8,11-12H,4,9-10,13H2,(H,20,25)(H,22,26)/p-1