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

Systemtic Name: 2-[(5-azanyl-4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(3-methylphenoxy)phenyl]ethanamide Openeye Name: 2-[(5-amino-4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(3-methylphenoxy)phenyl]acetamide CAS Name: 2-[(5-amino-4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[4-(3-methylphenoxy)phenyl]acetamide IUPAC Name: 2-[(5-amino-4-cyclopropyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(3-methylphenoxy)phenyl]acetamide Traditional Name: 2-[(5-amino-4-cyclopropyl-1,2,4-triazol-3-yl)thio]-N-[4-(3-methylphenoxy)phenyl]acetamide Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NN=C(N3C4CC4)N

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)NC(=O)CSC3=NN=C(N3C4CC4)N

InChI

InChI=1S/C20H21N5O2S/c1-13-3-2-4-17(11-13)27-16-9-5-14(6-10-16)22-18(26)12-28-20-24-23-19(21)25(20)15-7-8-15/h2-6,9-11,15H,7-8,12H2,1H3,(H2,21,23)(H,22,26)