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

Systemtic Name: N-[(2-methylcyclohexyl)carbamoyl]-2-[4-oxidanylidene-3-(3-oxidanylpropyl)quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: 2-[3-(3-hydroxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide CAS Name: 2-[[3-(3-hydroxypropyl)-4-oxo-2-quinazolinyl]thio]-N-[[(2-methylcyclohexyl)amino]-oxomethyl]acetamide IUPAC Name: 2-[3-(3-hydroxypropyl)-4-oxoquinazolin-2-yl]sulfanyl-N-[(2-methylcyclohexyl)carbamoyl]acetamide Traditional Name: 2-[[3-(3-hydroxypropyl)-4-keto-quinazolin-2-yl]thio]-N-[(2-methylcyclohexyl)carbamoyl]acetamide Formula: C21H28N4O4S MolecularWeight: 432.53642

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

Isomeric SMILES

CC1CCCCC1NC(=O)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCO

InChI

InChI=1S/C21H28N4O4S/c1-14-7-2-4-9-16(14)22-20(29)24-18(27)13-30-21-23-17-10-5-3-8-15(17)19(28)25(21)11-6-12-26/h3,5,8,10,14,16,26H,2,4,6-7,9,11-13H2,1H3,(H2,22,24,27,29)