2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-N-(3-propan-2-yloxypropyl)quinazoline-7-carboxamide

Systemtic Name: 2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxidanylidene-N-(3-propan-2-yloxypropyl)quinazoline-7-carboxamide Openeye Name: 2-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanyl-3-(2-furylmethyl)-N-(3-isopropoxypropyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-3-(2-furanylmethyl)-4-oxo-N-(3-propan-2-yloxypropyl)-7-quinazolinecarboxamide IUPAC Name: 2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-3-(furan-2-ylmethyl)-4-oxo-N-(3-propan-2-yloxypropyl)quinazoline-7-carboxamide Traditional Name: 2-[[2-(cyclohexylamino)-2-keto-ethyl]thio]-3-(2-furfuryl)-N-(3-isopropoxypropyl)-4-keto-quinazoline-7-carboxamide Formula: C28H36N4O5S MolecularWeight: 540.67424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)NC3CCCCC3)CC4=CC=CO4

Isomeric SMILES

CC(C)OCCCNC(=O)C1=CC2=C(C=C1)C(=O)N(C(=N2)SCC(=O)NC3CCCCC3)CC4=CC=CO4

InChI

InChI=1S/C28H36N4O5S/c1-19(2)36-15-7-13-29-26(34)20-11-12-23-24(16-20)31-28(32(27(23)35)17-22-10-6-14-37-22)38-18-25(33)30-21-8-4-3-5-9-21/h6,10-12,14,16,19,21H,3-5,7-9,13,15,17-18H2,1-2H3,(H,29,34)(H,30,33)