4-[[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N,N-dipropyl-benzamide

Systemtic Name: 4-[[4-chloranyl-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N,N-dipropyl-benzamide Openeye Name: 4-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N,N-dipropyl-benzamide CAS Name: 4-[[[4-chloro-6-[cyclohexyl(methyl)amino]-2-pyrimidinyl]thio]methyl]-N,N-dipropylbenzamide IUPAC Name: 4-[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]sulfanylmethyl]-N,N-dipropylbenzamide Traditional Name: 4-[[[4-chloro-6-[cyclohexyl(methyl)amino]pyrimidin-2-yl]thio]methyl]-N,N-dipropyl-benzamide Formula: C25H35ClN4OS MolecularWeight: 475.0896

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)Cl)N(C)C3CCCCC3

Isomeric SMILES

CCCN(CCC)C(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)Cl)N(C)C3CCCCC3

InChI

InChI=1S/C25H35ClN4OS/c1-4-15-30(16-5-2)24(31)20-13-11-19(12-14-20)18-32-25-27-22(26)17-23(28-25)29(3)21-9-7-6-8-10-21/h11-14,17,21H,4-10,15-16,18H2,1-3H3