N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(4-methyl-1,3-benzothiazol-2-yl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C22H25N3O3S2 MolecularWeight: 443.5822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)NC(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C22H25N3O3S2/c1-16-6-5-7-19-21(16)24-22(29-19)23-20(26)13-10-17-8-11-18(12-9-17)30(27,28)25-14-3-2-4-15-25/h5-9,11-12H,2-4,10,13-15H2,1H3,(H,23,24,26)