2-[[2-[(4-methylphenyl)methylsulfanyl]-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]aniline

Systemtic Name: 2-[[2-[(4-methylphenyl)methylsulfanyl]-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]aniline Openeye Name: 2-[[2-(p-tolylmethylsulfanyl)-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]aniline CAS Name: 2-[[2-[(4-methylphenyl)methylthio]-5,6,7,8-tetrahydroquinazolin-4-yl]thio]aniline IUPAC Name: 2-[[2-[(4-methylphenyl)methylsulfanyl]-5,6,7,8-tetrahydroquinazolin-4-yl]sulfanyl]aniline Traditional Name: [2-[[2-[(4-methylbenzyl)thio]-5,6,7,8-tetrahydroquinazolin-4-yl]thio]phenyl]amine Formula: C22H23N3S2 MolecularWeight: 393.56812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=C(CCCC3)C(=N2)SC4=CC=CC=C4N

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=C(CCCC3)C(=N2)SC4=CC=CC=C4N

InChI

InChI=1S/C22H23N3S2/c1-15-10-12-16(13-11-15)14-26-22-24-19-8-4-2-6-17(19)21(25-22)27-20-9-5-3-7-18(20)23/h3,5,7,9-13H,2,4,6,8,14,23H2,1H3