6-chloranyl-2-[(4-propan-2-ylphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(4-propan-2-ylphenyl)methylsulfanyl]-3-prop-2-enyl-quinazolin-4-one Openeye Name: 3-allyl-6-chloro-2-[(4-isopropylphenyl)methylsulfanyl]quinazolin-4-one CAS Name: 6-chloro-2-[(4-propan-2-ylphenyl)methylthio]-3-prop-2-enyl-4-quinazolinone IUPAC Name: 6-chloro-2-[(4-propan-2-ylphenyl)methylsulfanyl]-3-prop-2-enylquinazolin-4-one Traditional Name: 3-allyl-6-chloro-2-[(4-isopropylbenzyl)thio]quinazolin-4-one Formula: C21H21ClN2OS MolecularWeight: 384.92224

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CSC2=NC3=C(C=C(C=C3)Cl)C(=O)N2CC=C

InChI

InChI=1S/C21H21ClN2OS/c1-4-11-24-20(25)18-12-17(22)9-10-19(18)23-21(24)26-13-15-5-7-16(8-6-15)14(2)3/h4-10,12,14H,1,11,13H2,2-3H3