3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine

Systemtic Name: 3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine Openeye Name: 3-cyclohexyl-2-thioxo-1H-quinazolin-4-one; piperazine CAS Name: 3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine IUPAC Name: 3-cyclohexyl-2-sulfanylidene-1H-quinazolin-4-one; piperazine Traditional Name: 3-cyclohexyl-2-thioxo-1H-quinazolin-4-one; piperazine Formula: C32H42N6O2S2 MolecularWeight: 606.84488

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C14H16N2OS.C4H10N2/c2*17-13-11-8-4-5-9-12(11)15-14(18)16(13)10-6-2-1-3-7-10;1-2-6-4-3-5-1/h2*4-5,8-10H,1-3,6-7H2,(H,15,18);5-6H,1-4H2