4-(4-azanyl-2-methyl-phenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine

Systemtic Name: 4-(4-azanyl-2-methyl-phenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine Openeye Name: 4-(4-amino-2-methyl-phenyl)sulfanyl-N-(4-morpholinophenyl)pyrimidin-2-amine CAS Name: 4-[(4-amino-2-methylphenyl)thio]-N-[4-(4-morpholinyl)phenyl]-2-pyrimidinamine IUPAC Name: 4-(4-amino-2-methylphenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)pyrimidin-2-amine Traditional Name: [4-[(4-amino-2-methyl-phenyl)thio]pyrimidin-2-yl]-(4-morpholinophenyl)amine Formula: C21H23N5OS MolecularWeight: 393.50522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N)SC2=NC(=NC=C2)NC3=CC=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=C(C=CC(=C1)N)SC2=NC(=NC=C2)NC3=CC=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H23N5OS/c1-15-14-16(22)2-7-19(15)28-20-8-9-23-21(25-20)24-17-3-5-18(6-4-17)26-10-12-27-13-11-26/h2-9,14H,10-13,22H2,1H3,(H,23,24,25)