N-cyclohexyl-2-[4-oxidanylidene-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-ethanamide

Systemtic Name: N-cyclohexyl-2-[4-oxidanylidene-3-[4-oxidanylidene-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-ethanamide Openeye Name: N-cyclohexyl-2-[4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanyl-acetamide CAS Name: N-cyclohexyl-2-[[4-oxo-3-[4-oxo-4-(4-phenyl-1-piperazinyl)butyl]-2-quinazolinyl]thio]acetamide IUPAC Name: N-cyclohexyl-2-[4-oxo-3-[4-oxo-4-(4-phenylpiperazin-1-yl)butyl]quinazolin-2-yl]sulfanylacetamide Traditional Name: N-cyclohexyl-2-[[4-keto-3-[4-keto-4-(4-phenylpiperazino)butyl]quinazolin-2-yl]thio]acetamide Formula: C30H37N5O3S MolecularWeight: 547.71148

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCCC(=O)N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H37N5O3S/c36-27(31-23-10-3-1-4-11-23)22-39-30-32-26-15-8-7-14-25(26)29(38)35(30)17-9-16-28(37)34-20-18-33(19-21-34)24-12-5-2-6-13-24/h2,5-8,12-15,23H,1,3-4,9-11,16-22H2,(H,31,36)