N4-[(3-methoxyphenyl)methyl]-N6-[(4-thiomorpholin-4-ylcarbonylphenyl)methyl]pyrimidine-4,6-dicarboxamide

Systemtic Name: N4-[(3-methoxyphenyl)methyl]-N6-[(4-thiomorpholin-4-ylcarbonylphenyl)methyl]pyrimidine-4,6-dicarboxamide Openeye Name: N4-[(3-methoxyphenyl)methyl]-N6-[[4-(thiomorpholine-4-carbonyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide CAS Name: N4-[(3-methoxyphenyl)methyl]-N6-[[4-[oxo(thiomorpholin-4-yl)methyl]phenyl]methyl]pyrimidine-4,6-dicarboxamide IUPAC Name: 4-N-[(3-methoxyphenyl)methyl]-6-N-[[4-(thiomorpholine-4-carbonyl)phenyl]methyl]pyrimidine-4,6-dicarboxamide Traditional Name: N-m-anisyl-N'-[4-(thiomorpholine-4-carbonyl)benzyl]pyrimidine-4,6-dicarboxamide Formula: C26H27N5O4S MolecularWeight: 505.58868

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCSCC4

Isomeric SMILES

COC1=CC=CC(=C1)CNC(=O)C2=NC=NC(=C2)C(=O)NCC3=CC=C(C=C3)C(=O)N4CCSCC4

InChI

InChI=1S/C26H27N5O4S/c1-35-21-4-2-3-19(13-21)16-28-25(33)23-14-22(29-17-30-23)24(32)27-15-18-5-7-20(8-6-18)26(34)31-9-11-36-12-10-31/h2-8,13-14,17H,9-12,15-16H2,1H3,(H,27,32)(H,28,33)