2,6-bis(chloranyl)-4-methyl-N-[(3R)-3-[4-[2-methylsulfonylethanoyl(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]pyridine-3-carboxamide

Systemtic Name: 2,6-bis(chloranyl)-4-methyl-N-[(3R)-3-[4-[2-methylsulfonylethanoyl(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]pyridine-3-carboxamide Openeye Name: 2,6-dichloro-4-methyl-N-[(3R)-3-[4-[(2-methylsulfonylacetyl)-(3-thienylmethyl)amino]-1-piperidyl]butyl]pyridine-3-carboxamide CAS Name: 2,6-dichloro-4-methyl-N-[(3R)-3-[4-[(2-methylsulfonyl-1-oxoethyl)-(3-thiophenylmethyl)amino]-1-piperidinyl]butyl]-3-pyridinecarboxamide IUPAC Name: 2,6-dichloro-4-methyl-N-[(3R)-3-[4-[(2-methylsulfonylacetyl)-(thiophen-3-ylmethyl)amino]piperidin-1-yl]butyl]pyridine-3-carboxamide Traditional Name: 2,6-dichloro-N-[(3R)-3-[4-[(2-mesylacetyl)-(3-thenyl)amino]piperidino]butyl]-4-methyl-nicotinamide Formula: C24H32Cl2N4O4S2 MolecularWeight: 575.57128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1C(=O)NCCC(C)N2CCC(CC2)N(CC3=CSC=C3)C(=O)CS(=O)(=O)C)Cl)Cl

Isomeric SMILES

CC1=CC(=NC(=C1C(=O)NCC[C@@H](C)N2CCC(CC2)N(CC3=CSC=C3)C(=O)CS(=O)(=O)C)Cl)Cl

InChI

InChI=1S/C24H32Cl2N4O4S2/c1-16-12-20(25)28-23(26)22(16)24(32)27-8-4-17(2)29-9-5-19(6-10-29)30(13-18-7-11-35-14-18)21(31)15-36(3,33)34/h7,11-12,14,17,19H,4-6,8-10,13,15H2,1-3H3,(H,27,32)/t17-/m1/s1