4-[(3-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one

Systemtic Name: 4-[(3-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Openeye Name: 4-(m-tolylmethylsulfanyl)-1-(2-thienylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one CAS Name: 4-[(3-methylphenyl)methylthio]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one IUPAC Name: 4-[(3-methylphenyl)methylsulfanyl]-1-(thiophen-2-ylmethyl)-5,6,7,8-tetrahydroquinazolin-2-one Traditional Name: 4-[(3-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=C1)CSC2=NC(=O)N(C3=C2CCCC3)CC4=CC=CS4

Isomeric SMILES

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

InChI

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