N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[4-(4-tert-butylphenyl)sulfonylpiperazino]acetamide Formula: C23H28N4O3S2 MolecularWeight: 472.62342

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)CC(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C23H28N4O3S2/c1-23(2,3)17-8-10-18(11-9-17)32(29,30)27-14-12-26(13-15-27)16-21(28)25-22-24-19-6-4-5-7-20(19)31-22/h4-11H,12-16H2,1-3H3,(H,24,25,28)