N-[3-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-4-methyl-benzamide

Systemtic Name: N-[3-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-4-methyl-benzamide Openeye Name: N-[3-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]-4-methyl-benzamide CAS Name: N-[3-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-4-methylbenzamide IUPAC Name: N-[3-(3-methoxy-5-thiophen-2-yl-1,2,4-triazol-1-yl)phenyl]-4-methylbenzamide Traditional Name: N-[3-[3-methoxy-5-(2-thienyl)-1,2,4-triazol-1-yl]phenyl]-4-methyl-benzamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C(=NC(=N3)OC)C4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NC2=CC=CC(=C2)N3C(=NC(=N3)OC)C4=CC=CS4

InChI

InChI=1S/C21H18N4O2S/c1-14-8-10-15(11-9-14)20(26)22-16-5-3-6-17(13-16)25-19(18-7-4-12-28-18)23-21(24-25)27-2/h3-13H,1-2H3,(H,22,26)