N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide

Systemtic Name: N-[2-[(2,3-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonyl-benzamide Openeye Name: N-[2-(2,3-dimethylanilino)-2-oxo-ethyl]-4-[[(3S)-3-methyl-1-piperidyl]sulfonyl]benzamide CAS Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-4-[[(3S)-3-methyl-1-piperidinyl]sulfonyl]benzamide IUPAC Name: N-[2-(2,3-dimethylanilino)-2-oxoethyl]-4-[(3S)-3-methylpiperidin-1-yl]sulfonylbenzamide Traditional Name: N-[2-(2,3-dimethylanilino)-2-keto-ethyl]-4-[(3S)-3-methylpiperidino]sulfonyl-benzamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NC3=CC=CC(=C3C)C

Isomeric SMILES

C[C@H]1CCCN(C1)S(=O)(=O)C2=CC=C(C=C2)C(=O)NCC(=O)NC3=CC=CC(=C3C)C

InChI

InChI=1S/C23H29N3O4S/c1-16-6-5-13-26(15-16)31(29,30)20-11-9-19(10-12-20)23(28)24-14-22(27)25-21-8-4-7-17(2)18(21)3/h4,7-12,16H,5-6,13-15H2,1-3H3,(H,24,28)(H,25,27)/t16-/m0/s1