4-[1-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]indol-3-yl]-1-pyrrolidin-1-yl-butan-1-one

Systemtic Name: 4-[1-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]indol-3-yl]-1-pyrrolidin-1-yl-butan-1-one Openeye Name: 4-[1-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]indol-3-yl]-1-pyrrolidin-1-yl-butan-1-one CAS Name: 4-[1-[[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]methyl]-3-indolyl]-1-(1-pyrrolidinyl)-1-butanone IUPAC Name: 4-[1-[[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]methyl]indol-3-yl]-1-pyrrolidin-1-ylbutan-1-one Traditional Name: 4-[1-[[4-(1,2-benzothiazol-3-yl)piperazino]methyl]indol-3-yl]-1-pyrrolidino-butan-1-one Formula: C28H33N5OS MolecularWeight: 487.65952

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCCC2=CN(C3=CC=CC=C32)CN4CCN(CC4)C5=NSC6=CC=CC=C65

Isomeric SMILES

C1CCN(C1)C(=O)CCCC2=CN(C3=CC=CC=C32)CN4CCN(CC4)C5=NSC6=CC=CC=C65

InChI

InChI=1S/C28H33N5OS/c34-27(31-14-5-6-15-31)13-7-8-22-20-33(25-11-3-1-9-23(22)25)21-30-16-18-32(19-17-30)28-24-10-2-4-12-26(24)35-29-28/h1-4,9-12,20H,5-8,13-19,21H2