2-[1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole

Systemtic Name: 2-[1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole Openeye Name: 2-[1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole CAS Name: 2-[1-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]ethyl]-1,3-benzothiazole IUPAC Name: 2-[1-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]ethyl]-1,3-benzothiazole Traditional Name: 2-[1-(4-p-phenetylsulfonylpiperazino)ethyl]-1,3-benzothiazole Formula: C21H25N3O3S2 MolecularWeight: 431.5715

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H25N3O3S2/c1-3-27-17-8-10-18(11-9-17)29(25,26)24-14-12-23(13-15-24)16(2)21-22-19-6-4-5-7-20(19)28-21/h4-11,16H,3,12-15H2,1-2H3