3,3-dimethyl-2-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl]-6-pyrrol-1-yl-1,2-benzothiazole 1,1-dioxide

Systemtic Name: 3,3-dimethyl-2-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl]-6-pyrrol-1-yl-1,2-benzothiazole 1,1-dioxide Openeye Name: 3,3-dimethyl-2-[3-[4-(1-naphthyl)piperazin-1-yl]propyl]-6-pyrrol-1-yl-1,2-benzothiazole 1,1-dioxide CAS Name: 3,3-dimethyl-2-[3-[4-(1-naphthalenyl)-1-piperazinyl]propyl]-6-(1-pyrrolyl)-1,2-benzothiazole 1,1-dioxide IUPAC Name: 3,3-dimethyl-2-[3-(4-naphthalen-1-ylpiperazin-1-yl)propyl]-6-pyrrol-1-yl-1,2-benzothiazole 1,1-dioxide Traditional Name: 3,3-dimethyl-2-[3-[4-(1-naphthyl)piperazino]propyl]-6-pyrrol-1-yl-1,2-benzothiazole 1,1-dioxide Formula: C30H34N4O2S MolecularWeight: 514.68156

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=C(C=C(C=C2)N3C=CC=C3)S(=O)(=O)N1CCCN4CCN(CC4)C5=CC=CC6=CC=CC=C65)C

Isomeric SMILES

CC1(C2=C(C=C(C=C2)N3C=CC=C3)S(=O)(=O)N1CCCN4CCN(CC4)C5=CC=CC6=CC=CC=C65)C

InChI

InChI=1S/C30H34N4O2S/c1-30(2)27-14-13-25(32-16-5-6-17-32)23-29(27)37(35,36)34(30)18-8-15-31-19-21-33(22-20-31)28-12-7-10-24-9-3-4-11-26(24)28/h3-7,9-14,16-17,23H,8,15,18-22H2,1-2H3