prop-2-enyl 4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanoate

Systemtic Name: prop-2-enyl 4-[2,4-bis(oxidanylidene)-1H-quinazolin-3-yl]-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanoate Openeye Name: allyl 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynyl-amino]butanoate CAS Name: 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynylamino]butanoic acid prop-2-enyl ester IUPAC Name: prop-2-enyl 4-(2,4-dioxo-1H-quinazolin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-prop-2-ynylamino]butanoate Traditional Name: 4-(2,4-diketo-1H-quinazolin-3-yl)-2-[(4-phenoxyphenyl)sulfonyl-propargyl-amino]butyric acid allyl ester Formula: C30H27N3O7S MolecularWeight: 573.61628

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Descriptors Computed from Structure

Canonical SMILES:

C=CCOC(=O)C(CCN1C(=O)C2=CC=CC=C2NC1=O)N(CC#C)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

Isomeric SMILES

C=CCOC(=O)C(CCN1C(=O)C2=CC=CC=C2NC1=O)N(CC#C)S(=O)(=O)C3=CC=C(C=C3)OC4=CC=CC=C4

InChI

InChI=1S/C30H27N3O7S/c1-3-19-33(41(37,38)24-16-14-23(15-17-24)40-22-10-6-5-7-11-22)27(29(35)39-21-4-2)18-20-32-28(34)25-12-8-9-13-26(25)31-30(32)36/h1,4-17,27H,2,18-21H2,(H,31,36)