5-[[2,6-bis(chloranyl)phenyl]sulfanylmethyl]-N-cycloheptyl-pyridine-3-carboxamide

Systemtic Name: 5-[[2,6-bis(chloranyl)phenyl]sulfanylmethyl]-N-cycloheptyl-pyridine-3-carboxamide Openeye Name: N-cycloheptyl-5-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-3-carboxamide CAS Name: N-cycloheptyl-5-[[(2,6-dichlorophenyl)thio]methyl]-3-pyridinecarboxamide IUPAC Name: N-cycloheptyl-5-[(2,6-dichlorophenyl)sulfanylmethyl]pyridine-3-carboxamide Traditional Name: N-cycloheptyl-5-[[(2,6-dichlorophenyl)thio]methyl]nicotinamide Formula: C20H22Cl2N2OS MolecularWeight: 409.37248

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=CC(=CN=C2)CSC3=C(C=CC=C3Cl)Cl

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=CC(=CN=C2)CSC3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C20H22Cl2N2OS/c21-17-8-5-9-18(22)19(17)26-13-14-10-15(12-23-11-14)20(25)24-16-6-3-1-2-4-7-16/h5,8-12,16H,1-4,6-7,13H2,(H,24,25)