2-[7-chloranyl-3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclopropylmethyl)ethanamide

Systemtic Name: 2-[7-chloranyl-3-(2-methoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N-(cyclopropylmethyl)ethanamide Openeye Name: 2-[7-chloro-3-(2-methoxyphenyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(cyclopropylmethyl)acetamide CAS Name: 2-[[7-chloro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl]thio]-N-(cyclopropylmethyl)acetamide IUPAC Name: 2-[7-chloro-3-(2-methoxyphenyl)-4-oxoquinazolin-2-yl]sulfanyl-N-(cyclopropylmethyl)acetamide Traditional Name: 2-[[7-chloro-4-keto-3-(2-methoxyphenyl)quinazolin-2-yl]thio]-N-(cyclopropylmethyl)acetamide Formula: C21H20ClN3O3S MolecularWeight: 429.9198

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCC4CC4

Isomeric SMILES

COC1=CC=CC=C1N2C(=O)C3=C(C=C(C=C3)Cl)N=C2SCC(=O)NCC4CC4

InChI

InChI=1S/C21H20ClN3O3S/c1-28-18-5-3-2-4-17(18)25-20(27)15-9-8-14(22)10-16(15)24-21(25)29-12-19(26)23-11-13-6-7-13/h2-5,8-10,13H,6-7,11-12H2,1H3,(H,23,26)