1-[4-[3-(1,3-benzothiazol-2-yl)propanoyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one

Systemtic Name: 1-[4-[3-(1,3-benzothiazol-2-yl)propanoyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one Openeye Name: 1-[4-[3-(1,3-benzothiazol-2-yl)propanoyl]piperazin-1-yl]-2-methyl-2-phenyl-propan-1-one CAS Name: 1-[4-[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]-1-piperazinyl]-2-methyl-2-phenyl-1-propanone IUPAC Name: 1-[4-[3-(1,3-benzothiazol-2-yl)propanoyl]piperazin-1-yl]-2-methyl-2-phenylpropan-1-one Traditional Name: 1-[4-[3-(1,3-benzothiazol-2-yl)propanoyl]piperazino]-2-methyl-2-phenyl-propan-1-one Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)CCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)N2CCN(CC2)C(=O)CCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C24H27N3O2S/c1-24(2,18-8-4-3-5-9-18)23(29)27-16-14-26(15-17-27)22(28)13-12-21-25-19-10-6-7-11-20(19)30-21/h3-11H,12-17H2,1-2H3