N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-methyl-propanamide

Systemtic Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-methyl-propanamide Openeye Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidyl]sulfonyl]phenyl]-2-methyl-propanamide CAS Name: N-[4-[[4-(1,3-benzothiazol-2-yl)-1-piperidinyl]sulfonyl]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidin-1-yl]sulfonylphenyl]-2-methylpropanamide Traditional Name: N-[4-[4-(1,3-benzothiazol-2-yl)piperidino]sulfonylphenyl]-2-methyl-propionamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H25N3O3S2/c1-15(2)21(26)23-17-7-9-18(10-8-17)30(27,28)25-13-11-16(12-14-25)22-24-19-5-3-4-6-20(19)29-22/h3-10,15-16H,11-14H2,1-2H3,(H,23,26)