N'-[2-(2-methylphenyl)sulfanylethanoyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide

Systemtic Name: N'-[2-(2-methylphenyl)sulfanylethanoyl]-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide Openeye Name: N'-[2-(o-tolylsulfanyl)acetyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide CAS Name: N'-[2-[(2-methylphenyl)thio]-1-oxoethyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide IUPAC Name: N'-[2-(2-methylphenyl)sulfanylacetyl]-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide Traditional Name: 9-keto-N'-[2-(o-tolylthio)acetyl]-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carbohydrazide Formula: C21H20N4O3S MolecularWeight: 408.4735

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)NNC(=O)C2=CC3=C(C=C2)C(=O)N4CCCC4=N3

InChI

InChI=1S/C21H20N4O3S/c1-13-5-2-3-6-17(13)29-12-19(26)23-24-20(27)14-8-9-15-16(11-14)22-18-7-4-10-25(18)21(15)28/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,23,26)(H,24,27)