6-bromanyl-3-[6-[4-(4-ethanoylphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-3-[6-[4-(4-ethanoylphenyl)piperazin-1-yl]-6-oxidanylidene-hexyl]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[6-[4-(4-acetylphenyl)piperazin-1-yl]-6-oxo-hexyl]-6-bromo-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[6-[4-(4-acetylphenyl)-1-piperazinyl]-6-oxohexyl]-6-bromo-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[6-[4-(4-acetylphenyl)piperazin-1-yl]-6-oxohexyl]-6-bromo-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[6-[4-(4-acetylphenyl)piperazino]-6-keto-hexyl]-6-bromo-2-thioxo-1H-quinazolin-4-one Formula: C26H29BrN4O3S MolecularWeight: 557.50246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=O)CCCCCN3C(=O)C4=C(C=CC(=C4)Br)NC3=S

InChI

InChI=1S/C26H29BrN4O3S/c1-18(32)19-6-9-21(10-7-19)29-13-15-30(16-14-29)24(33)5-3-2-4-12-31-25(34)22-17-20(27)8-11-23(22)28-26(31)35/h6-11,17H,2-5,12-16H2,1H3,(H,28,35)