4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-2-(oxidanylamino)-N-(4-phenoxyphenyl)sulfonyl-N-prop-2-ynyl-butanamide

Systemtic Name: 4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-2-(oxidanylamino)-N-(4-phenoxyphenyl)sulfonyl-N-prop-2-ynyl-butanamide Openeye Name: 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-(hydroxyamino)-N-(4-phenoxyphenyl)sulfonyl-N-prop-2-ynyl-butanamide CAS Name: 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-(hydroxyamino)-N-(4-phenoxyphenyl)sulfonyl-N-prop-2-ynylbutanamide IUPAC Name: 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-(hydroxyamino)-N-(4-phenoxyphenyl)sulfonyl-N-prop-2-ynylbutanamide Traditional Name: 4-(2,4-diketo-1H-quinazolin-3-yl)-2-(hydroxyamino)-N-(4-phenoxyphenyl)sulfonyl-N-propargyl-butyramide Formula: C27H24N4O7S MolecularWeight: 548.56706

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Descriptors Computed from Structure

Canonical SMILES:

C#CCN(C(=O)C(CCN1C(=O)C2=CC=CC=C2NC1=O)NO)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C#CCN(C(=O)C(CCN1C(=O)C2=CC=CC=C2NC1=O)NO)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C27H24N4O7S/c1-2-17-31(39(36,37)21-14-12-20(13-15-21)38-19-8-4-3-5-9-19)26(33)24(29-35)16-18-30-25(32)22-10-6-7-11-23(22)28-27(30)34/h1,3-15,24,29,35H,16-18H2,(H,28,34)