2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)pentanamide

Systemtic Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)pentanamide Openeye Name: N-benzyl-2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-pentanamide CAS Name: 2-[[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-(phenylmethyl)pentanamide IUPAC Name: N-benzyl-2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanylpentanamide Traditional Name: N-benzyl-2-[[5-(4-tert-butylbenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]valeramide Formula: C29H37N3O2S MolecularWeight: 491.68798

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(=O)NCC1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)C(C)(C)C)C

Isomeric SMILES

CCCC(C(=O)NCC1=CC=CC=C1)SC2=NC(=C(C(=O)N2C)CC3=CC=C(C=C3)C(C)(C)C)C

InChI

InChI=1S/C29H37N3O2S/c1-7-11-25(26(33)30-19-22-12-9-8-10-13-22)35-28-31-20(2)24(27(34)32(28)6)18-21-14-16-23(17-15-21)29(3,4)5/h8-10,12-17,25H,7,11,18-19H2,1-6H3,(H,30,33)