3-[2-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-cyclohexyl-propanamide

Systemtic Name: 3-[2-[2-[(3-chloranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-cyclohexyl-propanamide Openeye Name: 3-[2-[2-(3-chloro-4-methyl-anilino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]-N-cyclohexyl-propanamide CAS Name: 3-[2-[[2-(3-chloro-4-methylanilino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-N-cyclohexylpropanamide IUPAC Name: 3-[2-[2-(3-chloro-4-methylanilino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]-N-cyclohexylpropanamide Traditional Name: 3-[2-[[2-(3-chloro-4-methyl-anilino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]-N-cyclohexyl-propionamide Formula: C26H29ClN4O3S MolecularWeight: 513.05146

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NC4CCCCC4)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NC4CCCCC4)Cl

InChI

InChI=1S/C26H29ClN4O3S/c1-17-11-12-19(15-21(17)27)29-24(33)16-35-26-30-22-10-6-5-9-20(22)25(34)31(26)14-13-23(32)28-18-7-3-2-4-8-18/h5-6,9-12,15,18H,2-4,7-8,13-14,16H2,1H3,(H,28,32)(H,29,33)