6-chloranyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]quinazolin-4-one CAS Name: 6-chloro-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[(3,5-dimethylisoxazol-4-yl)methylthio]quinazolin-4-one Formula: C17H16ClN3O2S MolecularWeight: 361.84584

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C17H16ClN3O2S/c1-4-7-21-16(22)13-8-12(18)5-6-15(13)19-17(21)24-9-14-10(2)20-23-11(14)3/h4-6,8H,1,7,9H2,2-3H3