N-(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(prop-2-ynylsulfamoyl)benzamide

Systemtic Name: N-(9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(prop-2-ynylsulfamoyl)benzamide Openeye Name: N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(prop-2-ynylsulfamoyl)benzamide CAS Name: N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(prop-2-ynylsulfamoyl)benzamide IUPAC Name: N-(9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(prop-2-ynylsulfamoyl)benzamide Traditional Name: N-(9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazolin-7-yl)-4-(propargylsulfamoyl)benzamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C4CCCN4C3=O

Isomeric SMILES

C#CCNS(=O)(=O)C1=CC=C(C=C1)C(=O)NC2=CC3=C(C=C2)N=C4CCCN4C3=O

InChI

InChI=1S/C21H18N4O4S/c1-2-11-22-30(28,29)16-8-5-14(6-9-16)20(26)23-15-7-10-18-17(13-15)21(27)25-12-3-4-19(25)24-18/h1,5-10,13,22H,3-4,11-12H2,(H,23,26)