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

Systemtic Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxidanylidene-pyrimidin-2-yl]sulfanyl-N-cyclopropyl-propanamide Openeye Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-pyrimidin-2-yl]sulfanyl-N-cyclopropyl-propanamide CAS Name: 2-[[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxo-2-pyrimidinyl]thio]-N-cyclopropylpropanamide IUPAC Name: 2-[5-[(4-tert-butylphenyl)methyl]-1,4-dimethyl-6-oxopyrimidin-2-yl]sulfanyl-N-cyclopropylpropanamide Traditional Name: 2-[[5-(4-tert-butylbenzyl)-6-keto-1,4-dimethyl-pyrimidin-2-yl]thio]-N-cyclopropyl-propionamide Formula: C23H31N3O2S MolecularWeight: 413.57614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N(C(=N1)SC(C)C(=O)NC2CC2)C)CC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC1=C(C(=O)N(C(=N1)SC(C)C(=O)NC2CC2)C)CC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C23H31N3O2S/c1-14-19(13-16-7-9-17(10-8-16)23(3,4)5)21(28)26(6)22(24-14)29-15(2)20(27)25-18-11-12-18/h7-10,15,18H,11-13H2,1-6H3,(H,25,27)