6,8-bis(bromanyl)-3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine

Systemtic Name: 6,8-bis(bromanyl)-3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine Openeye Name: 6,8-dibromo-3-cyclohexyl-2-thioxo-1H-quinazolin-4-one; piperazine CAS Name: 6,8-dibromo-3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine IUPAC Name: 6,8-dibromo-3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine Traditional Name: 6,8-dibromo-3-cyclohexyl-2-thioxo-1H-quinazolin-4-one; piperazine Formula: C32H38Br4N6O2S2 MolecularWeight: 922.42912

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=CC(=CC(=C3NC2=S)Br)Br.C1CCC(CC1)N2C(=O)C3=CC(=CC(=C3NC2=S)Br)Br.C1CNCCN1

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=CC(=CC(=C3NC2=S)Br)Br.C1CCC(CC1)N2C(=O)C3=CC(=CC(=C3NC2=S)Br)Br.C1CNCCN1

InChI

InChI=1S/2C14H14Br2N2OS.C4H10N2/c2*15-8-6-10-12(11(16)7-8)17-14(20)18(13(10)19)9-4-2-1-3-5-9;1-2-6-4-3-5-1/h2*6-7,9H,1-5H2,(H,17,20);5-6H,1-4H2