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

Systemtic Name: N-(2-dimethylaminoethyl)-4-[[4-[methyl-(phenylmethyl)amino]-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]benzamide Openeye Name: 4-[[4-[benzyl(methyl)amino]-6-phenyl-pyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide CAS Name: N-(2-dimethylaminoethyl)-4-[[[4-[methyl-(phenylmethyl)amino]-6-phenyl-2-pyrimidinyl]thio]methyl]benzamide IUPAC Name: 4-[[4-[benzyl(methyl)amino]-6-phenylpyrimidin-2-yl]sulfanylmethyl]-N-(2-dimethylaminoethyl)benzamide Traditional Name: 4-[[[4-[benzyl(methyl)amino]-6-phenyl-pyrimidin-2-yl]thio]methyl]-N-(2-dimethylaminoethyl)benzamide Formula: C30H33N5OS MolecularWeight: 511.68092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H33N5OS/c1-34(2)19-18-31-29(36)26-16-14-24(15-17-26)22-37-30-32-27(25-12-8-5-9-13-25)20-28(33-30)35(3)21-23-10-6-4-7-11-23/h4-17,20H,18-19,21-22H2,1-3H3,(H,31,36)