4-[(4-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one

Systemtic Name: 4-[(4-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Openeye Name: 4-(p-tolylmethylsulfanyl)-1-(2-thienylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one CAS Name: 4-[(4-methylphenyl)methylthio]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one IUPAC Name: 4-[(4-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Traditional Name: 4-[(4-methylbenzyl)thio]-1-(2-thenyl)-5,6,7,8-tetrahydroquinazolin-2-one Formula: C21H22N2OS2 MolecularWeight: 382.54218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CS4

InChI

InChI=1S/C21H22N2OS2/c1-15-8-10-16(11-9-15)14-26-20-18-6-2-3-7-19(18)23(21(24)22-20)13-17-5-4-12-25-17/h4-5,8-12H,2-3,6-7,13-14H2,1H3