2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-morpholin-4-yl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]sulfanyl-6-morpholin-4-yl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxo-ethyl]sulfanyl-6-morpholino-quinazolin-4-one CAS Name: 2-[[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-oxoethyl]thio]-6-(4-morpholinyl)-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-2-oxoethyl]sulfanyl-6-morpholin-4-ylquinazolin-4-one Traditional Name: 3-benzyl-2-[[2-keto-2-[4-(2-methoxyphenyl)piperazino]ethyl]thio]-6-morpholino-quinazolin-4-one Formula: C32H35N5O4S MolecularWeight: 585.7164

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=C(C=C(C=C4)N5CCOCC5)C(=O)N3CC6=CC=CC=C6

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)C(=O)CSC3=NC4=C(C=C(C=C4)N5CCOCC5)C(=O)N3CC6=CC=CC=C6

InChI

InChI=1S/C32H35N5O4S/c1-40-29-10-6-5-9-28(29)35-13-15-36(16-14-35)30(38)23-42-32-33-27-12-11-25(34-17-19-41-20-18-34)21-26(27)31(39)37(32)22-24-7-3-2-4-8-24/h2-12,21H,13-20,22-23H2,1H3