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

Systemtic Name: 4-[(2-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Openeye Name: 4-(o-tolylmethylsulfanyl)-1-(2-thienylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one CAS Name: 4-[(2-methylphenyl)methylthio]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one IUPAC Name: 4-[(2-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Traditional Name: 4-[(2-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=CC=C1CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CS4

Isomeric SMILES

CC1=CC=CC=C1CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CS4

InChI

InChI=1S/C21H22N2OS2/c1-15-7-2-3-8-16(15)14-26-20-18-10-4-5-11-19(18)23(21(24)22-20)13-17-9-6-12-25-17/h2-3,6-9,12H,4-5,10-11,13-14H2,1H3