2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyethyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyethyl)-4-oxo-2-quinazolinyl]thio]-N-[[(2-methylcyclohexyl)amino]-oxomethyl]acetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyethyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyethyl)quinazolin-2-yl]thio]-N-[(2-methylcyclohexyl)carbamoyl]acetamide Formula: C21H27ClN4O4S MolecularWeight: 466.98148

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

Isomeric SMILES

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CCOC

InChI

InChI=1S/C21H27ClN4O4S/c1-13-5-3-4-6-16(13)23-20(29)25-18(27)12-31-21-24-17-11-14(22)7-8-15(17)19(28)26(21)9-10-30-2/h7-8,11,13,16H,3-6,9-10,12H2,1-2H3,(H2,23,25,27,29)