N-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-4-methoxy-benzamide

Systemtic Name: N-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]-4-methoxy-benzamide Openeye Name: N-[2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-methoxy-benzamide CAS Name: N-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-4-methoxybenzamide IUPAC Name: N-[2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]acetyl]-4-methoxy-benzamide Formula: C20H20N4O3S2 MolecularWeight: 428.5278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2C3CC3)CC4=CC=CS4

InChI

InChI=1S/C20H20N4O3S2/c1-27-15-8-4-13(5-9-15)19(26)21-18(25)12-29-20-23-22-17(24(20)14-6-7-14)11-16-3-2-10-28-16/h2-5,8-10,14H,6-7,11-12H2,1H3,(H,21,25,26)