2-[(2-chlorophenyl)methylsulfanyl]-N-cyclohexyl-quinazolin-4-amine

Systemtic Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-cyclohexyl-quinazolin-4-amine Openeye Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-cyclohexyl-quinazolin-4-amine CAS Name: 2-[(2-chlorophenyl)methylthio]-N-cyclohexyl-4-quinazolinamine IUPAC Name: 2-[(2-chlorophenyl)methylsulfanyl]-N-cyclohexylquinazolin-4-amine Traditional Name: [2-[(2-chlorobenzyl)thio]quinazolin-4-yl]-cyclohexyl-amine Formula: C21H22ClN3S MolecularWeight: 383.93748

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)SCC4=CC=CC=C4Cl

Isomeric SMILES

C1CCC(CC1)NC2=NC(=NC3=CC=CC=C32)SCC4=CC=CC=C4Cl

InChI

InChI=1S/C21H22ClN3S/c22-18-12-6-4-8-15(18)14-26-21-24-19-13-7-5-11-17(19)20(25-21)23-16-9-2-1-3-10-16/h4-8,11-13,16H,1-3,9-10,14H2,(H,23,24,25)