2-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(furan-2-ylmethyl)-4-oxidanylidene-3-prop-2-enyl-quinazoline-7-carboxamide

Systemtic Name: 2-[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl]sulfanyl-N-(furan-2-ylmethyl)-4-oxidanylidene-3-prop-2-enyl-quinazoline-7-carboxamide Openeye Name: 3-allyl-2-[2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl]sulfanyl-N-(2-furylmethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 2-[[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]thio]-N-(2-furanylmethyl)-4-oxo-3-prop-2-enyl-7-quinazolinecarboxamide IUPAC Name: 2-[2-[(2-chlorophenyl)methylamino]-2-oxoethyl]sulfanyl-N-(furan-2-ylmethyl)-4-oxo-3-prop-2-enylquinazoline-7-carboxamide Traditional Name: 3-allyl-2-[[2-[(2-chlorobenzyl)amino]-2-keto-ethyl]thio]-N-(2-furfuryl)-4-keto-quinazoline-7-carboxamide Formula: C26H23ClN4O4S MolecularWeight: 523.00322

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)N=C1SCC(=O)NCC4=CC=CC=C4Cl

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC3=CC=CO3)N=C1SCC(=O)NCC4=CC=CC=C4Cl

InChI

InChI=1S/C26H23ClN4O4S/c1-2-11-31-25(34)20-10-9-17(24(33)29-15-19-7-5-12-35-19)13-22(20)30-26(31)36-16-23(32)28-14-18-6-3-4-8-21(18)27/h2-10,12-13H,1,11,14-16H2,(H,28,32)(H,29,33)