1-[4-[4-[(3-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]phenyl]ethanone

Systemtic Name: 1-[4-[4-[(3-methyl-1-benzothiophen-2-yl)carbonyl]piperazin-1-yl]phenyl]ethanone Openeye Name: 1-[4-[4-(3-methylbenzothiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone CAS Name: 1-[4-[4-[(3-methyl-1-benzothiophen-2-yl)-oxomethyl]-1-piperazinyl]phenyl]ethanone IUPAC Name: 1-[4-[4-(3-methyl-1-benzothiophene-2-carbonyl)piperazin-1-yl]phenyl]ethanone Traditional Name: 1-[4-[4-(3-methylbenzothiophene-2-carbonyl)piperazino]phenyl]ethanone Formula: C22H22N2O2S MolecularWeight: 378.48728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=CC=CC=C12)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

Isomeric SMILES

CC1=C(SC2=CC=CC=C12)C(=O)N3CCN(CC3)C4=CC=C(C=C4)C(=O)C

InChI

InChI=1S/C22H22N2O2S/c1-15-19-5-3-4-6-20(19)27-21(15)22(26)24-13-11-23(12-14-24)18-9-7-17(8-10-18)16(2)25/h3-10H,11-14H2,1-2H3