(4-oxidanylidene-2-phenyl-1H-quinazolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate

Systemtic Name: (4-oxidanylidene-2-phenyl-1H-quinazolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate Openeye Name: (4-oxo-2-phenyl-1H-quinazolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate CAS Name: 4-methyl-1-piperazinecarbodithioic acid (4-oxo-2-phenyl-1H-quinazolin-6-yl)methyl ester IUPAC Name: (4-oxo-2-phenyl-1H-quinazolin-6-yl)methyl 4-methylpiperazine-1-carbodithioate Traditional Name: 4-methylpiperazine-1-carbodithioic acid (4-keto-2-phenyl-1H-quinazolin-6-yl)methyl ester Formula: C21H22N4OS2 MolecularWeight: 410.55558

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=S)SCC2=CC3=C(C=C2)NC(=NC3=O)C4=CC=CC=C4

Isomeric SMILES

CN1CCN(CC1)C(=S)SCC2=CC3=C(C=C2)NC(=NC3=O)C4=CC=CC=C4

InChI

InChI=1S/C21H22N4OS2/c1-24-9-11-25(12-10-24)21(27)28-14-15-7-8-18-17(13-15)20(26)23-19(22-18)16-5-3-2-4-6-16/h2-8,13H,9-12,14H2,1H3,(H,22,23,26)