[4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone

Systemtic Name: [4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone Openeye Name: [4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(p-tolylsulfonyl)pyrrolidin-2-yl]methanone CAS Name: [4-(4-ethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-[1-(4-methylphenyl)sulfonyl-2-pyrrolidinyl]methanone IUPAC Name: [4-(4-ethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-[1-(4-methylphenyl)sulfonylpyrrolidin-2-yl]methanone Traditional Name: [4-(4-ethyl-1,3-benzothiazol-2-yl)piperazino]-(1-tosylpyrrolidin-2-yl)methanone Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)C

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4CCCN4S(=O)(=O)C5=CC=C(C=C5)C

InChI

InChI=1S/C25H30N4O3S2/c1-3-19-6-4-8-22-23(19)26-25(33-22)28-16-14-27(15-17-28)24(30)21-7-5-13-29(21)34(31,32)20-11-9-18(2)10-12-20/h4,6,8-12,21H,3,5,7,13-17H2,1-2H3