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

Systemtic Name: 2-[(4-azanyl-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]ethanamide Openeye Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide CAS Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide IUPAC Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide Traditional Name: 2-[(4-amino-5-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide Formula: C17H23N5O3S MolecularWeight: 377.46122

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23N5O3S/c1-2-24-13-5-7-14(8-6-13)25-10-9-19-15(23)11-26-17-21-20-16(22(17)18)12-3-4-12/h5-8,12H,2-4,9-11,18H2,1H3,(H,19,23)