2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one

Systemtic Name: 2-[(3-chloranyl-4-methyl-quinolin-2-yl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one Openeye Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylsulfanyl]-3-cyclopropyl-quinazolin-4-one CAS Name: 2-[(3-chloro-4-methyl-2-quinolinyl)methylthio]-3-cyclopropyl-4-quinazolinone IUPAC Name: 2-[(3-chloro-4-methylquinolin-2-yl)methylsulfanyl]-3-cyclopropylquinazolin-4-one Traditional Name: 2-[(3-chloro-4-methyl-2-quinolyl)methylthio]-3-cyclopropyl-quinazolin-4-one Formula: C22H18ClN3OS MolecularWeight: 407.91582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5)Cl

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CSC3=NC4=CC=CC=C4C(=O)N3C5CC5)Cl

InChI

InChI=1S/C22H18ClN3OS/c1-13-15-6-2-4-8-17(15)24-19(20(13)23)12-28-22-25-18-9-5-3-7-16(18)21(27)26(22)14-10-11-14/h2-9,14H,10-12H2,1H3