N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)sulfonyl-N-methyl-piperidine-4-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)sulfonyl-N-methyl-4-piperidinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-1-(4-ethoxyphenyl)sulfonyl-N-methylpiperidine-4-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-methyl-1-p-phenetylsulfonyl-isonipecotamide Formula: C22H25N3O4S2 MolecularWeight: 459.5816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)N(C)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O4S2/c1-3-29-17-8-10-18(11-9-17)31(27,28)25-14-12-16(13-15-25)21(26)24(2)22-23-19-6-4-5-7-20(19)30-22/h4-11,16H,3,12-15H2,1-2H3