N-(cyclohexen-1-yl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)ethanamide

Systemtic Name: N-(cyclohexen-1-yl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)ethanamide Openeye Name: N-(cyclohexen-1-yl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)acetamide CAS Name: N-(1-cyclohexenyl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxyethyl)acetamide IUPAC Name: N-(cyclohexen-1-yl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(2-methoxyethyl)acetamide Traditional Name: N-(cyclohexen-1-yl)-2-[(5-cyclopropyl-1-phenyl-1,2,4-triazol-3-yl)thio]-N-(2-methoxyethyl)acetamide Formula: C22H28N4O2S MolecularWeight: 412.54832

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(C1=CCCCC1)C(=O)CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4

Isomeric SMILES

COCCN(C1=CCCCC1)C(=O)CSC2=NN(C(=N2)C3CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H28N4O2S/c1-28-15-14-25(18-8-4-2-5-9-18)20(27)16-29-22-23-21(17-12-13-17)26(24-22)19-10-6-3-7-11-19/h3,6-8,10-11,17H,2,4-5,9,12-16H2,1H3