N-(furan-2-ylmethyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide

Systemtic Name: N-(furan-2-ylmethyl)-2-(6-morpholin-4-yl-4-oxidanylidene-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide Openeye Name: N-(2-furylmethyl)-2-(6-morpholino-4-oxo-3-phenethyl-quinazolin-2-yl)sulfanyl-butanamide CAS Name: N-(2-furanylmethyl)-2-[[6-(4-morpholinyl)-4-oxo-3-phenethyl-2-quinazolinyl]thio]butanamide IUPAC Name: N-(furan-2-ylmethyl)-2-(6-morpholin-4-yl-4-oxo-3-phenethylquinazolin-2-yl)sulfanylbutanamide Traditional Name: N-(2-furfuryl)-2-[(4-keto-6-morpholino-3-phenethyl-quinazolin-2-yl)thio]butyramide Formula: C29H32N4O4S MolecularWeight: 532.65378

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=CO1)SC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

Isomeric SMILES

CCC(C(=O)NCC1=CC=CO1)SC2=NC3=C(C=C(C=C3)N4CCOCC4)C(=O)N2CCC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O4S/c1-2-26(27(34)30-20-23-9-6-16-37-23)38-29-31-25-11-10-22(32-14-17-36-18-15-32)19-24(25)28(35)33(29)13-12-21-7-4-3-5-8-21/h3-11,16,19,26H,2,12-15,17-18,20H2,1H3,(H,30,34)