[6-chloranyl-2-methylsulfanyl-5-[(4-propoxyphenyl)methyl]pyrimidin-4-yl]methanamine

Systemtic Name: [6-chloranyl-2-methylsulfanyl-5-[(4-propoxyphenyl)methyl]pyrimidin-4-yl]methanamine Openeye Name: [6-chloro-2-methylsulfanyl-5-[(4-propoxyphenyl)methyl]pyrimidin-4-yl]methanamine CAS Name: [6-chloro-2-(methylthio)-5-[(4-propoxyphenyl)methyl]-4-pyrimidinyl]methanamine IUPAC Name: [6-chloro-2-methylsulfanyl-5-[(4-propoxyphenyl)methyl]pyrimidin-4-yl]methanamine Traditional Name: [6-chloro-2-(methylthio)-5-(4-propoxybenzyl)pyrimidin-4-yl]methylamine Formula: C16H20ClN3OS MolecularWeight: 337.8675

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)CN

Isomeric SMILES

CCCOC1=CC=C(C=C1)CC2=C(N=C(N=C2Cl)SC)CN

InChI

InChI=1S/C16H20ClN3OS/c1-3-8-21-12-6-4-11(5-7-12)9-13-14(10-18)19-16(22-2)20-15(13)17/h4-7H,3,8-10,18H2,1-2H3