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

Systemtic Name: (2-ethyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl 4-(phenylmethyl)piperazine-1-carbodithioate Openeye Name: (2-ethyl-4-oxo-1H-quinazolin-6-yl)methyl 4-benzylpiperazine-1-carbodithioate CAS Name: 4-(phenylmethyl)-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-benzylpiperazine-1-carbodithioate Traditional Name: 4-benzylpiperazine-1-carbodithioic acid (2-ethyl-4-keto-1H-quinazolin-6-yl)methyl ester Formula: C23H26N4OS2 MolecularWeight: 438.60874

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=O)C2=C(N1)C=CC(=C2)CSC(=S)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CCC1=NC(=O)C2=C(N1)C=CC(=C2)CSC(=S)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H26N4OS2/c1-2-21-24-20-9-8-18(14-19(20)22(28)25-21)16-30-23(29)27-12-10-26(11-13-27)15-17-6-4-3-5-7-17/h3-9,14H,2,10-13,15-16H2,1H3,(H,24,25,28)