1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-5-methyl-indole-2,3-dione

Systemtic Name: 1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-5-methyl-indole-2,3-dione Openeye Name: 1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-5-methyl-indoline-2,3-dione CAS Name: 1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]-1-piperazinyl]methyl]-5-methylindole-2,3-dione IUPAC Name: 1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazin-1-yl]methyl]-5-methylindole-2,3-dione Traditional Name: 1-[[4-[1-(1,3-benzothiazol-2-yl)ethyl]piperazino]methyl]-5-methyl-isatin Formula: C23H24N4O2S MolecularWeight: 420.52726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)C(C)C4=NC5=CC=CC=C5S4

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)C2=O)CN3CCN(CC3)C(C)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H24N4O2S/c1-15-7-8-19-17(13-15)21(28)23(29)27(19)14-25-9-11-26(12-10-25)16(2)22-24-18-5-3-4-6-20(18)30-22/h3-8,13,16H,9-12,14H2,1-2H3