N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[(3-methylthiophen-2-yl)carbonylamino]piperidine-4-carboxamide

Systemtic Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[(3-methylthiophen-2-yl)carbonylamino]piperidine-4-carboxamide Openeye Name: 4-[(3-methylthiophene-2-carbonyl)amino]-N-[2-(p-tolylsulfonylamino)ethyl]piperidine-4-carboxamide CAS Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[[(3-methyl-2-thiophenyl)-oxomethyl]amino]-4-piperidinecarboxamide IUPAC Name: N-[2-[(4-methylphenyl)sulfonylamino]ethyl]-4-[(3-methylthiophene-2-carbonyl)amino]piperidine-4-carboxamide Traditional Name: 4-[(3-methylthiophene-2-carbonyl)amino]-N-[2-(tosylamino)ethyl]isonipecotamide Formula: C21H28N4O4S2 MolecularWeight: 464.60142

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)C3=C(C=CS3)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C2(CCNCC2)NC(=O)C3=C(C=CS3)C

InChI

InChI=1S/C21H28N4O4S2/c1-15-3-5-17(6-4-15)31(28,29)24-13-12-23-20(27)21(8-10-22-11-9-21)25-19(26)18-16(2)7-14-30-18/h3-7,14,22,24H,8-13H2,1-2H3,(H,23,27)(H,25,26)