2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methoxyphenyl)carbamoyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methoxyphenyl)carbamoyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methoxyphenyl)carbamoyl]acetamide CAS Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[(4-methoxyanilino)-oxomethyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-methoxyphenyl)carbamoyl]acetamide Traditional Name: 2-[(4-amino-5-cyclohexyl-1,2,4-triazol-3-yl)thio]-N-[(4-methoxyphenyl)carbamoyl]acetamide Formula: C18H24N6O3S MolecularWeight: 404.48656

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NN=C(N2N)C3CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC(=O)CSC2=NN=C(N2N)C3CCCCC3

InChI

InChI=1S/C18H24N6O3S/c1-27-14-9-7-13(8-10-14)20-17(26)21-15(25)11-28-18-23-22-16(24(18)19)12-5-3-2-4-6-12/h7-10,12H,2-6,11,19H2,1H3,(H2,20,21,25,26)