N-cyclohexyl-3-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanamide

Systemtic Name: N-cyclohexyl-3-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]propanamide Openeye Name: N-cyclohexyl-3-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]propanamide CAS Name: N-cyclohexyl-3-[2-[[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]propanamide IUPAC Name: N-cyclohexyl-3-[2-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]propanamide Traditional Name: N-cyclohexyl-3-[2-[[2-(homoveratrylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]propionamide Formula: C29H36N4O5S MolecularWeight: 552.68494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NC4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2CCC(=O)NC4CCCCC4)OC

InChI

InChI=1S/C29H36N4O5S/c1-37-24-13-12-20(18-25(24)38-2)14-16-30-27(35)19-39-29-32-23-11-7-6-10-22(23)28(36)33(29)17-15-26(34)31-21-8-4-3-5-9-21/h6-7,10-13,18,21H,3-5,8-9,14-17,19H2,1-2H3,(H,30,35)(H,31,34)