3-hexyl-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]sulfanyl-quinazolin-4-one

Systemtic Name: 3-hexyl-2-[2-oxidanylidene-2-(4-thiophen-2-ylcarbonylpiperazin-1-yl)ethyl]sulfanyl-quinazolin-4-one Openeye Name: 3-hexyl-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]sulfanyl-quinazolin-4-one CAS Name: 3-hexyl-2-[[2-oxo-2-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]ethyl]thio]-4-quinazolinone IUPAC Name: 3-hexyl-2-[2-oxo-2-[4-(thiophene-2-carbonyl)piperazin-1-yl]ethyl]sulfanylquinazolin-4-one Traditional Name: 3-hexyl-2-[[2-keto-2-[4-(2-thenoyl)piperazino]ethyl]thio]quinazolin-4-one Formula: C25H30N4O3S2 MolecularWeight: 498.6607

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

Isomeric SMILES

CCCCCCN1C(=O)C2=CC=CC=C2N=C1SCC(=O)N3CCN(CC3)C(=O)C4=CC=CS4

InChI

InChI=1S/C25H30N4O3S2/c1-2-3-4-7-12-29-23(31)19-9-5-6-10-20(19)26-25(29)34-18-22(30)27-13-15-28(16-14-27)24(32)21-11-8-17-33-21/h5-6,8-11,17H,2-4,7,12-16,18H2,1H3