N-(3,4-dihydro-2H-thiochromen-4-yl)-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide

Systemtic Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: 9-oxo-N-thiochroman-4-yl-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: N-(3,4-dihydro-2H-1-benzothiopyran-4-yl)-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-(3,4-dihydro-2H-thiochromen-4-yl)-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: 9-keto-N-thiochroman-4-yl-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)NC4CCSC5=CC=CC=C45)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)NC4CCSC5=CC=CC=C45)C(=O)N2C1

InChI

InChI=1S/C21H19N3O2S/c25-20(23-16-9-11-27-18-5-2-1-4-14(16)18)13-7-8-15-17(12-13)22-19-6-3-10-24(19)21(15)26/h1-2,4-5,7-8,12,16H,3,6,9-11H2,(H,23,25)