1-[4-(3,4-dimethylphenyl)-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone

Systemtic Name: 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Openeye Name: 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone CAS Name: 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone IUPAC Name: 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-thiophen-2-yl-3H-1,2,4-triazol-5-yl]ethanone Traditional Name: 1-[4-(3,4-dimethylphenyl)-2-phenyl-3-(2-thienyl)-3H-1,2,4-triazol-5-yl]ethanone Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=CC=C3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(N(N=C2C(=O)C)C3=CC=CC=C3)C4=CC=CS4)C

InChI

InChI=1S/C22H21N3OS/c1-15-11-12-19(14-16(15)2)24-21(17(3)26)23-25(18-8-5-4-6-9-18)22(24)20-10-7-13-27-20/h4-14,22H,1-3H3