3-[(4-tert-butylphenyl)methyl]-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one

Systemtic Name: 3-[(4-tert-butylphenyl)methyl]-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Openeye Name: 3-[(4-tert-butylphenyl)methyl]-2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one CAS Name: 3-[(4-tert-butylphenyl)methyl]-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one IUPAC Name: 3-[(4-tert-butylphenyl)methyl]-2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-one Traditional Name: 3-(4-tert-butylbenzyl)-2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one Formula: C22H26N2OS MolecularWeight: 366.51964

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4=CC=C(C=C4)C(C)(C)C

Isomeric SMILES

CC1=NC2=C(C3=C(S2)CCCC3)C(=O)N1CC4=CC=C(C=C4)C(C)(C)C

InChI

InChI=1S/C22H26N2OS/c1-14-23-20-19(17-7-5-6-8-18(17)26-20)21(25)24(14)13-15-9-11-16(12-10-15)22(2,3)4/h9-12H,5-8,13H2,1-4H3