(2-ethyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl 4-phenylpiperazine-1-carbodithioate

Systemtic Name: (2-ethyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl 4-phenylpiperazine-1-carbodithioate Openeye Name: (2-ethyl-4-oxo-1H-quinazolin-6-yl)methyl 4-phenylpiperazine-1-carbodithioate CAS Name: 4-phenyl-1-piperazinecarbodithioic acid (2-ethyl-4-oxo-1H-quinazolin-6-yl)methyl ester IUPAC Name: (2-ethyl-4-oxo-1H-quinazolin-6-yl)methyl 4-phenylpiperazine-1-carbodithioate Traditional Name: 4-phenylpiperazine-1-carbodithioic acid (2-ethyl-4-keto-1H-quinazolin-6-yl)methyl ester Formula: C22H24N4OS2 MolecularWeight: 424.58216

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=O)C2=C(N1)C=CC(=C2)CSC(=S)N3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC1=NC(=O)C2=C(N1)C=CC(=C2)CSC(=S)N3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4OS2/c1-2-20-23-19-9-8-16(14-18(19)21(27)24-20)15-29-22(28)26-12-10-25(11-13-26)17-6-4-3-5-7-17/h3-9,14H,2,10-13,15H2,1H3,(H,23,24,27)