2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-ethyl-ethanamide

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-ethyl-ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxy-3-methoxy-phenyl)methyl]-N-ethyl-acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-ethylacetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[(4-ethoxy-3-methoxyphenyl)methyl]-N-ethylacetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-(4-ethoxy-3-methoxy-benzyl)-N-ethyl-acetamide Formula: C19H27N5O3S MolecularWeight: 405.51438

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OCC)OC)C(=O)CSC2=NN=C(N2N)C3CC3

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OCC)OC)C(=O)CSC2=NN=C(N2N)C3CC3

InChI

InChI=1S/C19H27N5O3S/c1-4-23(11-13-6-9-15(27-5-2)16(10-13)26-3)17(25)12-28-19-22-21-18(24(19)20)14-7-8-14/h6,9-10,14H,4-5,7-8,11-12,20H2,1-3H3