N-(1,3-benzothiazol-2-yl)-1-methylsulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-methylsulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-(4-isopropylphenyl)-1-methylsulfonyl-piperidine-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-methylsulfonyl-N-(4-propan-2-ylphenyl)-3-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-methylsulfonyl-N-(4-propan-2-ylphenyl)piperidine-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-1-mesyl-N-p-cumenyl-nipecotamide Formula: C23H27N3O3S2 MolecularWeight: 457.60878

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CCCN(C4)S(=O)(=O)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N(C2=NC3=CC=CC=C3S2)C(=O)C4CCCN(C4)S(=O)(=O)C

InChI

InChI=1S/C23H27N3O3S2/c1-16(2)17-10-12-19(13-11-17)26(23-24-20-8-4-5-9-21(20)30-23)22(27)18-7-6-14-25(15-18)31(3,28)29/h4-5,8-13,16,18H,6-7,14-15H2,1-3H3