N-(5-acetamido-2-methoxy-phenyl)-2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(5-acetamido-2-methoxyphenyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(5-acetamido-2-methoxyphenyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(5-acetamido-2-methoxy-phenyl)-2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C19H26N6O3S MolecularWeight: 418.51314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2N)C3CCCCC3

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)OC)NC(=O)CSC2=NN=C(N2N)C3CCCCC3

InChI

InChI=1S/C19H26N6O3S/c1-12(26)21-14-8-9-16(28-2)15(10-14)22-17(27)11-29-19-24-23-18(25(19)20)13-6-4-3-5-7-13/h8-10,13H,3-7,11,20H2,1-2H3,(H,21,26)(H,22,27)