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

Systemtic Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]ethanamide Openeye Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide CAS Name: 2-[[4-cyclopropyl-5-(1-pyrrolidinyl)-1,2,4-triazol-3-yl]thio]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide IUPAC Name: 2-[(4-cyclopropyl-5-pyrrolidin-1-yl-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide Traditional Name: 2-[(4-cyclopropyl-5-pyrrolidino-1,2,4-triazol-3-yl)thio]-N-[2-(4-ethoxyphenoxy)ethyl]acetamide Formula: C21H29N5O3S MolecularWeight: 431.55166

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)OCCNC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)OCCNC(=O)CSC2=NN=C(N2C3CC3)N4CCCC4

InChI

InChI=1S/C21H29N5O3S/c1-2-28-17-7-9-18(10-8-17)29-14-11-22-19(27)15-30-21-24-23-20(25-12-3-4-13-25)26(21)16-5-6-16/h7-10,16H,2-6,11-15H2,1H3,(H,22,27)