[4-(2-ethoxyphenyl)piperazin-1-yl]-[2-[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]methanone

Systemtic Name: [4-(2-ethoxyphenyl)piperazin-1-yl]-[2-[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]methanone Openeye Name: [2-[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]thiazol-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone CAS Name: [4-(2-ethoxyphenyl)-1-piperazinyl]-[2-[[[4-(2-methoxyphenyl)-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]methyl]-4-thiazolyl]methanone IUPAC Name: [2-[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-1,3-thiazol-4-yl]-[4-(2-ethoxyphenyl)piperazin-1-yl]methanone Traditional Name: [2-[[[5-benzyl-4-(2-methoxyphenyl)-1,2,4-triazol-3-yl]thio]methyl]thiazol-4-yl]-(4-o-phenetylpiperazino)methanone Formula: C33H34N6O3S2 MolecularWeight: 626.79146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CSC(=N3)CSC4=NN=C(N4C5=CC=CC=C5OC)CC6=CC=CC=C6

Isomeric SMILES

CCOC1=CC=CC=C1N2CCN(CC2)C(=O)C3=CSC(=N3)CSC4=NN=C(N4C5=CC=CC=C5OC)CC6=CC=CC=C6

InChI

InChI=1S/C33H34N6O3S2/c1-3-42-29-16-10-7-13-26(29)37-17-19-38(20-18-37)32(40)25-22-43-31(34-25)23-44-33-36-35-30(21-24-11-5-4-6-12-24)39(33)27-14-8-9-15-28(27)41-2/h4-16,22H,3,17-21,23H2,1-2H3