2-[1-(2-azanylpyridin-4-yl)-3-(2-dimethylaminoethylamino)-2-oxidanylidene-propyl]sulfanyl-N-(4-chlorophenyl)pyridine-3-carboxamide

Systemtic Name: 2-[1-(2-azanylpyridin-4-yl)-3-(2-dimethylaminoethylamino)-2-oxidanylidene-propyl]sulfanyl-N-(4-chlorophenyl)pyridine-3-carboxamide Openeye Name: 2-[1-(2-amino-4-pyridyl)-3-(2-dimethylaminoethylamino)-2-oxo-propyl]sulfanyl-N-(4-chlorophenyl)pyridine-3-carboxamide CAS Name: 2-[[1-(2-amino-4-pyridinyl)-3-(2-dimethylaminoethylamino)-2-oxopropyl]thio]-N-(4-chlorophenyl)-3-pyridinecarboxamide IUPAC Name: 2-[1-(2-aminopyridin-4-yl)-3-(2-dimethylaminoethylamino)-2-oxopropyl]sulfanyl-N-(4-chlorophenyl)pyridine-3-carboxamide Traditional Name: 2-[[1-(2-amino-4-pyridyl)-3-(2-dimethylaminoethylamino)-2-keto-propyl]thio]-N-(4-chlorophenyl)nicotinamide Formula: C24H27ClN6O2S MolecularWeight: 499.02818

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCNCC(=O)C(C1=CC(=NC=C1)N)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)Cl

Isomeric SMILES

CN(C)CCNCC(=O)C(C1=CC(=NC=C1)N)SC2=C(C=CC=N2)C(=O)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C24H27ClN6O2S/c1-31(2)13-12-27-15-20(32)22(16-9-11-28-21(26)14-16)34-24-19(4-3-10-29-24)23(33)30-18-7-5-17(25)6-8-18/h3-11,14,22,27H,12-13,15H2,1-2H3,(H2,26,28)(H,30,33)