N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide

Systemtic Name: N'-[4-(4-chloranyl-2-methyl-phenoxy)butanoyl]-4-oxidanylidene-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Openeye Name: 3-allyl-N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-4-oxo-2-thioxo-1H-quinazoline-7-carbohydrazide CAS Name: N'-[4-(4-chloro-2-methylphenoxy)-1-oxobutyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: N'-[4-(4-chloro-2-methylphenoxy)butanoyl]-4-oxo-3-prop-2-enyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Traditional Name: 3-allyl-N'-[4-(4-chloro-2-methyl-phenoxy)butanoyl]-4-keto-2-thioxo-1H-quinazoline-7-carbohydrazide Formula: C23H23ClN4O4S MolecularWeight: 486.97112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)OCCCC(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CC=C

InChI

InChI=1S/C23H23ClN4O4S/c1-3-10-28-22(31)17-8-6-15(13-18(17)25-23(28)33)21(30)27-26-20(29)5-4-11-32-19-9-7-16(24)12-14(19)2/h3,6-9,12-13H,1,4-5,10-11H2,2H3,(H,25,33)(H,26,29)(H,27,30)