N'-cyclopropylcarbonyl-4-oxidanylidene-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide

Systemtic Name: N'-cyclopropylcarbonyl-4-oxidanylidene-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Openeye Name: N'-(cyclopropanecarbonyl)-4-oxo-3-phenethyl-2-thioxo-1H-quinazoline-7-carbohydrazide CAS Name: N'-[cyclopropyl(oxo)methyl]-4-oxo-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide IUPAC Name: N'-(cyclopropanecarbonyl)-4-oxo-3-phenethyl-2-sulfanylidene-1H-quinazoline-7-carbohydrazide Traditional Name: N'-(cyclopropanecarbonyl)-4-keto-3-phenethyl-2-thioxo-1H-quinazoline-7-carbohydrazide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCC4=CC=CC=C4

Isomeric SMILES

C1CC1C(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N(C(=S)N3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H20N4O3S/c26-18(14-6-7-14)23-24-19(27)15-8-9-16-17(12-15)22-21(29)25(20(16)28)11-10-13-4-2-1-3-5-13/h1-5,8-9,12,14H,6-7,10-11H2,(H,22,29)(H,23,26)(H,24,27)