2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]ethanamide

Systemtic Name: 2-[3-(4-cyanophenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]ethanamide Openeye Name: 2-[3-(4-cyanophenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide CAS Name: 2-[[3-(4-cyanophenyl)-4-oxo-2-quinazolinyl]thio]-N-[[(2-methylcyclohexyl)amino]-oxomethyl]acetamide IUPAC Name: 2-[3-(4-cyanophenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide Traditional Name: 2-[[3-(4-cyanophenyl)-4-keto-quinazolin-2-yl]thio]-N-[(2-methylcyclohexyl)carbamoyl]acetamide Formula: C25H25N5O3S MolecularWeight: 475.5627

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4=CC=C(C=C4)C#N

InChI

InChI=1S/C25H25N5O3S/c1-16-6-2-4-8-20(16)27-24(33)29-22(31)15-34-25-28-21-9-5-3-7-19(21)23(32)30(25)18-12-10-17(14-26)11-13-18/h3,5,7,9-13,16,20H,2,4,6,8,15H2,1H3,(H2,27,29,31,33)