N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide

Systemtic Name: N-[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Openeye Name: 3-allyl-N-[2-(2-furylmethylamino)-2-oxo-ethyl]-4-oxo-2-thioxo-1H-quinazoline-7-carboxamide CAS Name: N-[2-(2-furanylmethylamino)-2-oxoethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide IUPAC Name: N-[2-(furan-2-ylmethylamino)-2-oxoethyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carboxamide Traditional Name: 3-allyl-N-[2-(2-furfurylamino)-2-keto-ethyl]-4-keto-2-thioxo-1H-quinazoline-7-carboxamide Formula: C19H18N4O4S MolecularWeight: 398.43562

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3)NC1=S

Isomeric SMILES

C=CCN1C(=O)C2=C(C=C(C=C2)C(=O)NCC(=O)NCC3=CC=CO3)NC1=S

InChI

InChI=1S/C19H18N4O4S/c1-2-7-23-18(26)14-6-5-12(9-15(14)22-19(23)28)17(25)21-11-16(24)20-10-13-4-3-8-27-13/h2-6,8-9H,1,7,10-11H2,(H,20,24)(H,21,25)(H,22,28)