1-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanone

Systemtic Name: 1-[4-(4-methylphenyl)carbonylpiperazin-1-yl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanone Openeye Name: 1-[4-(4-methylbenzoyl)piperazin-1-yl]-2-[2-(3-thienyl)thiazol-4-yl]ethanone CAS Name: 1-[4-[(4-methylphenyl)-oxomethyl]-1-piperazinyl]-2-[2-(3-thiophenyl)-4-thiazolyl]ethanone IUPAC Name: 1-[4-(4-methylbenzoyl)piperazin-1-yl]-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)ethanone Traditional Name: 1-(4-p-toluoylpiperazino)-2-[2-(3-thienyl)thiazol-4-yl]ethanone Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CC3=CSC(=N3)C4=CSC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CC3=CSC(=N3)C4=CSC=C4

InChI

InChI=1S/C21H21N3O2S2/c1-15-2-4-16(5-3-15)21(26)24-9-7-23(8-10-24)19(25)12-18-14-28-20(22-18)17-6-11-27-13-17/h2-6,11,13-14H,7-10,12H2,1H3