4-[[4-[methyl-(phenylmethyl)amino]-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-benzamide

Systemtic Name: 4-[[4-[methyl-(phenylmethyl)amino]-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-propan-2-yl-benzamide Openeye Name: 4-[[4-[benzyl(methyl)amino]-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-isopropyl-benzamide CAS Name: 4-[[[4-[methyl-(phenylmethyl)amino]-6-phenyl-2-pyrimidinyl]thio]methyl]-N-propan-2-ylbenzamide IUPAC Name: 4-[[4-[benzyl(methyl)amino]-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-propan-2-ylbenzamide Traditional Name: 4-[[[4-[benzyl(methyl)amino]-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-isopropyl-benzamide Formula: C29H30N4OS MolecularWeight: 482.6397

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)NC(=O)C1=CC=C(C=C1)CSC2=NC(=CC(=N2)N(C)CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C29H30N4OS/c1-21(2)30-28(34)25-16-14-23(15-17-25)20-35-29-31-26(24-12-8-5-9-13-24)18-27(32-29)33(3)19-22-10-6-4-7-11-22/h4-18,21H,19-20H2,1-3H3,(H,30,34)