4-[2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(phenylmethyl)butanamide

Systemtic Name: 4-[2-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-quinazolin-3-yl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-[2-[2-(2-furylmethylamino)-2-oxo-ethyl]sulfanyl-4-oxo-quinazolin-3-yl]butanamide CAS Name: 4-[2-[[2-(2-furanylmethylamino)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-[2-[2-(furan-2-ylmethylamino)-2-oxoethyl]sulfanyl-4-oxoquinazolin-3-yl]butanamide Traditional Name: N-benzyl-4-[2-[[2-(2-furfurylamino)-2-keto-ethyl]thio]-4-keto-quinazolin-3-yl]butyramide Formula: C26H26N4O4S MolecularWeight: 490.57404

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=CO4

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CCCN2C(=O)C3=CC=CC=C3N=C2SCC(=O)NCC4=CC=CO4

InChI

InChI=1S/C26H26N4O4S/c31-23(27-16-19-8-2-1-3-9-19)13-6-14-30-25(33)21-11-4-5-12-22(21)29-26(30)35-18-24(32)28-17-20-10-7-15-34-20/h1-5,7-12,15H,6,13-14,16-18H2,(H,27,31)(H,28,32)