2-[2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]pyrrol-1-yl]-6-methyl-1,3-benzothiazole

Systemtic Name: 2-[2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]pyrrol-1-yl]-6-methyl-1,3-benzothiazole Openeye Name: 2-[2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]pyrrol-1-yl]-6-methyl-1,3-benzothiazole CAS Name: 2-[2-[[4-(2,3-dimethylphenyl)-1-piperazinyl]methyl]-1-pyrrolyl]-6-methyl-1,3-benzothiazole IUPAC Name: 2-[2-[[4-(2,3-dimethylphenyl)piperazin-1-yl]methyl]pyrrol-1-yl]-6-methyl-1,3-benzothiazole Traditional Name: 2-[2-[[4-(2,3-dimethylphenyl)piperazino]methyl]pyrrol-1-yl]-6-methyl-1,3-benzothiazole Formula: C25H28N4S MolecularWeight: 416.58162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CN4CCN(CC4)C5=CC=CC(=C5C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)N3C=CC=C3CN4CCN(CC4)C5=CC=CC(=C5C)C

InChI

InChI=1S/C25H28N4S/c1-18-9-10-22-24(16-18)30-25(26-22)29-11-5-7-21(29)17-27-12-14-28(15-13-27)23-8-4-6-19(2)20(23)3/h4-11,16H,12-15,17H2,1-3H3