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

Systemtic Name: 2-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]sulfanyl-3-(furan-2-ylmethyl)-N-(2-methoxyethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 2-[2-(cyclohexylamino)-2-oxo-ethyl]sulfanyl-3-(2-furylmethyl)-N-(2-methoxyethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[[2-(cyclohexylamino)-2-oxoethyl]thio]-3-(2-furanylmethyl)-N-(2-methoxyethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 2-[2-(cyclohexylamino)-2-oxoethyl]sulfanyl-3-(furan-2-ylmethyl)-N-(2-methoxyethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 2-[[2-(cyclohexylamino)-2-keto-ethyl]thio]-3-(2-furfuryl)-4-keto-N-(2-methoxyethyl)quinazoline-7-carboxamide Formula: C25H30N4O5S MolecularWeight: 498.5945

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O5S/c1-33-13-11-26-23(31)17-9-10-20-21(14-17)28-25(29(24(20)32)15-19-8-5-12-34-19)35-16-22(30)27-18-6-3-2-4-7-18/h5,8-10,12,14,18H,2-4,6-7,11,13,15-16H2,1H3,(H,26,31)(H,27,30)