N-cyclopentyl-2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide

Systemtic Name: N-cyclopentyl-2-[2-(4-ethoxyphenyl)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Openeye Name: N-cyclopentyl-2-[2-(4-ethoxyphenyl)-2-oxo-ethyl]sulfanyl-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazoline-7-carboxamide CAS Name: N-cyclopentyl-2-[[2-(4-ethoxyphenyl)-2-oxoethyl]thio]-4-oxo-3-(2-oxolanylmethyl)-7-quinazolinecarboxamide IUPAC Name: N-cyclopentyl-2-[2-(4-ethoxyphenyl)-2-oxoethyl]sulfanyl-4-oxo-3-(oxolan-2-ylmethyl)quinazoline-7-carboxamide Traditional Name: N-cyclopentyl-4-keto-2-[(2-keto-2-p-phenetyl-ethyl)thio]-3-(tetrahydrofurfuryl)quinazoline-7-carboxamide Formula: C29H33N3O5S MolecularWeight: 535.65442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2CC5CCCO5

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)CSC2=NC3=C(C=CC(=C3)C(=O)NC4CCCC4)C(=O)N2CC5CCCO5

InChI

InChI=1S/C29H33N3O5S/c1-2-36-22-12-9-19(10-13-22)26(33)18-38-29-31-25-16-20(27(34)30-21-6-3-4-7-21)11-14-24(25)28(35)32(29)17-23-8-5-15-37-23/h9-14,16,21,23H,2-8,15,17-18H2,1H3,(H,30,34)