1-[(3R)-4-tert-butyl-2-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[(3R)-4-tert-butyl-2-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[(3R)-4-tert-butyl-2-(p-tolyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[(3R)-4-tert-butyl-2-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[(3R)-4-tert-butyl-2-(4-methylphenyl)-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[(3R)-4-tert-butyl-2-(p-tolyl)-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone Formula: C19H23N3OS MolecularWeight: 341.47042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(N(C(=N2)C(=O)C)C(C)(C)C)C3=CC=CS3

Isomeric SMILES

CC1=CC=C(C=C1)N2[C@@H](N(C(=N2)C(=O)C)C(C)(C)C)C3=CC=CS3

InChI

InChI=1S/C19H23N3OS/c1-13-8-10-15(11-9-13)22-18(16-7-6-12-24-16)21(19(3,4)5)17(20-22)14(2)23/h6-12,18H,1-5H3/t18-/m1/s1