N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-4-methyl-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-4-methyl-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-4-methyl-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(1S)-2-(dimethylamino)-1-phenylethyl]-4-methyl-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(1S)-2-(dimethylamino)-1-phenyl-ethyl]-4-methyl-3-piperidinosulfonyl-benzamide Formula: C23H31N3O3S MolecularWeight: 429.57554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC(CN(C)C)C2=CC=CC=C2)S(=O)(=O)N3CCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N[C@H](CN(C)C)C2=CC=CC=C2)S(=O)(=O)N3CCCCC3

InChI

InChI=1S/C23H31N3O3S/c1-18-12-13-20(16-22(18)30(28,29)26-14-8-5-9-15-26)23(27)24-21(17-25(2)3)19-10-6-4-7-11-19/h4,6-7,10-13,16,21H,5,8-9,14-15,17H2,1-3H3,(H,24,27)/t21-/m1/s1