N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: 2-[4-(4-isopropylphenyl)sulfonylpiperazin-1-yl]-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]acetamide CAS Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-[4-(4-propan-2-ylphenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-2-(4-p-cumenylsulfonylpiperazino)acetamide Formula: C29H32N4O3S2 MolecularWeight: 548.71938

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CN4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)C

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=O)CN4CCN(CC4)S(=O)(=O)C5=CC=C(C=C5)C(C)C

InChI

InChI=1S/C29H32N4O3S2/c1-20(2)22-7-11-25(12-8-22)38(35,36)33-16-14-32(15-17-33)19-28(34)30-24-9-5-23(6-10-24)29-31-26-13-4-21(3)18-27(26)37-29/h4-13,18,20H,14-17,19H2,1-3H3,(H,30,34)