N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-propyl-amino]ethanamide

Systemtic Name: N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-propyl-amino]ethanamide Openeye Name: N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-propyl-amino]acetamide CAS Name: N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-propylamino]acetamide IUPAC Name: N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-propylamino]acetamide Traditional Name: N-(2-methoxyphenyl)-2-[(4-methyl-3-phenyl-5-thioxo-1,2,4-triazol-1-yl)methyl-propyl-amino]acetamide Formula: C22H27N5O2S MolecularWeight: 425.54708

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CC(=O)NC1=CC=CC=C1OC)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C

Isomeric SMILES

CCCN(CC(=O)NC1=CC=CC=C1OC)CN2C(=S)N(C(=N2)C3=CC=CC=C3)C

InChI

InChI=1S/C22H27N5O2S/c1-4-14-26(15-20(28)23-18-12-8-9-13-19(18)29-3)16-27-22(30)25(2)21(24-27)17-10-6-5-7-11-17/h5-13H,4,14-16H2,1-3H3,(H,23,28)