4-[(4-chloranyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(1,2-diphenylethyl)benzamide

Systemtic Name: 4-[(4-chloranyl-6-morpholin-4-yl-pyrimidin-2-yl)sulfanylmethyl]-N-(1,2-diphenylethyl)benzamide Openeye Name: 4-[(4-chloro-6-morpholino-pyrimidin-2-yl)sulfanylmethyl]-N-(1,2-diphenylethyl)benzamide CAS Name: 4-[[[4-chloro-6-(4-morpholinyl)-2-pyrimidinyl]thio]methyl]-N-(1,2-diphenylethyl)benzamide IUPAC Name: 4-[(4-chloro-6-morpholin-4-ylpyrimidin-2-yl)sulfanylmethyl]-N-(1,2-diphenylethyl)benzamide Traditional Name: 4-[[(4-chloro-6-morpholino-pyrimidin-2-yl)thio]methyl]-N-(1,2-diphenylethyl)benzamide Formula: C30H29ClN4O2S MolecularWeight: 545.09486

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC(CC4=CC=CC=C4)C5=CC=CC=C5)Cl

Isomeric SMILES

C1COCCN1C2=CC(=NC(=N2)SCC3=CC=C(C=C3)C(=O)NC(CC4=CC=CC=C4)C5=CC=CC=C5)Cl

InChI

InChI=1S/C30H29ClN4O2S/c31-27-20-28(35-15-17-37-18-16-35)34-30(33-27)38-21-23-11-13-25(14-12-23)29(36)32-26(24-9-5-2-6-10-24)19-22-7-3-1-4-8-22/h1-14,20,26H,15-19,21H2,(H,32,36)