N-[(3-chlorophenyl)methyl]-4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-[(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide Openeye Name: N-[(3-chlorophenyl)methyl]-4-[(4-oxo-2-thioxo-1H-quinazolin-3-yl)methyl]cyclohexanecarboxamide CAS Name: N-[(3-chlorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]-1-cyclohexanecarboxamide IUPAC Name: N-[(3-chlorophenyl)methyl]-4-[(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)methyl]cyclohexane-1-carboxamide Traditional Name: N-(3-chlorobenzyl)-4-[(4-keto-2-thioxo-1H-quinazolin-3-yl)methyl]cyclohexanecarboxamide Formula: C23H24ClN3O2S MolecularWeight: 441.97356

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=S)C(=O)NCC4=CC(=CC=C4)Cl

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3NC2=S)C(=O)NCC4=CC(=CC=C4)Cl

InChI

InChI=1S/C23H24ClN3O2S/c24-18-5-3-4-16(12-18)13-25-21(28)17-10-8-15(9-11-17)14-27-22(29)19-6-1-2-7-20(19)26-23(27)30/h1-7,12,15,17H,8-11,13-14H2,(H,25,28)(H,26,30)