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

Systemtic Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Openeye Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide CAS Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide IUPAC Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Traditional Name: N-(4,6-dimethyl-1,3-benzothiazol-2-yl)-9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxamide Formula: C21H18N4O2S MolecularWeight: 390.45822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4)C

Isomeric SMILES

CC1=CC(=C2C(=C1)SC(=N2)NC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4)C

InChI

InChI=1S/C21H18N4O2S/c1-11-8-12(2)18-16(9-11)28-21(23-18)24-19(26)13-5-6-14-15(10-13)22-17-4-3-7-25(17)20(14)27/h5-6,8-10H,3-4,7H2,1-2H3,(H,23,24,26)