3-(1,3-benzodioxol-5-ylmethyl)-N-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3,4-dichlorophenyl)methyl]-4-oxidanylidene-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3,4-dichlorophenyl)methyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3,4-dichlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: 3-(1,3-benzodioxol-5-ylmethyl)-N-[(3,4-dichlorophenyl)methyl]-4-oxo-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: N-(3,4-dichlorobenzyl)-4-keto-3-piperonyl-2-thioxo-1H-quinazoline-7-carboxamide Formula: C24H17Cl2N3O4S MolecularWeight: 514.38048

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=C(C=C4)C(=O)NCC5=CC(=C(C=C5)Cl)Cl)NC3=S

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)CN3C(=O)C4=C(C=C(C=C4)C(=O)NCC5=CC(=C(C=C5)Cl)Cl)NC3=S

InChI

InChI=1S/C24H17Cl2N3O4S/c25-17-5-1-13(7-18(17)26)10-27-22(30)15-3-4-16-19(9-15)28-24(34)29(23(16)31)11-14-2-6-20-21(8-14)33-12-32-20/h1-9H,10-12H2,(H,27,30)(H,28,34)