2-(3-methylphenyl)-N-(1-phenylethyl)-4-thiomorpholin-4-yl-pyrimidine-5-carboxamide

Systemtic Name: 2-(3-methylphenyl)-N-(1-phenylethyl)-4-thiomorpholin-4-yl-pyrimidine-5-carboxamide Openeye Name: 2-(m-tolyl)-N-(1-phenylethyl)-4-thiomorpholino-pyrimidine-5-carboxamide CAS Name: 2-(3-methylphenyl)-N-(1-phenylethyl)-4-thiomorpholin-4-yl-5-pyrimidinecarboxamide IUPAC Name: 2-(3-methylphenyl)-N-(1-phenylethyl)-4-thiomorpholin-4-ylpyrimidine-5-carboxamide Traditional Name: 2-(m-tolyl)-N-(1-phenylethyl)-4-thiomorpholino-pyrimidine-5-carboxamide Formula: C24H26N4OS MolecularWeight: 418.55444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC=C(C(=N2)N3CCSCC3)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC=C(C(=N2)N3CCSCC3)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C24H26N4OS/c1-17-7-6-10-20(15-17)22-25-16-21(23(27-22)28-11-13-30-14-12-28)24(29)26-18(2)19-8-4-3-5-9-19/h3-10,15-16,18H,11-14H2,1-2H3,(H,26,29)