2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxyphenyl)methyl]-N-methyl-ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxyphenyl)methyl]-N-methyl-ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxyphenyl)methyl]-N-methyl-acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(4-ethoxyphenyl)methyl]-N-methylacetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxyphenyl)methyl]-N-methylacetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-ethoxybenzyl)-N-methyl-acetamide Formula: C17H23N5O2S MolecularWeight: 361.46182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN(C)C(=O)CSC2=NN=C(N2N)C3CC3

Isomeric SMILES

CCOC1=CC=C(C=C1)CN(C)C(=O)CSC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C17H23N5O2S/c1-3-24-14-8-4-12(5-9-14)10-21(2)15(23)11-25-17-20-19-16(22(17)18)13-6-7-13/h4-5,8-9,13H,3,6-7,10-11,18H2,1-2H3