3-(3-butoxyphenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-(3-butoxyphenyl)carbonyl-6,8-bis(chloranyl)-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-(3-butoxybenzoyl)-6,8-dichloro-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(3-butoxyphenyl)-oxomethyl]-6,8-dichloro-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-(3-butoxybenzoyl)-6,8-dichloro-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-(3-butoxybenzoyl)-6,8-dichloro-2-thioxo-1H-quinazolin-4-one Formula: C19H16Cl2N2O3S MolecularWeight: 423.31294

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)N2C(=O)C3=CC(=CC(=C3NC2=S)Cl)Cl

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)N2C(=O)C3=CC(=CC(=C3NC2=S)Cl)Cl

InChI

InChI=1S/C19H16Cl2N2O3S/c1-2-3-7-26-13-6-4-5-11(8-13)17(24)23-18(25)14-9-12(20)10-15(21)16(14)22-19(23)27/h4-6,8-10H,2-3,7H2,1H3,(H,22,27)