N-(1,3-benzothiazol-2-yl)-N-ethyl-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-12-oxidanylidene-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-12-oxo-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-N-ethyl-12-keto-7,8,9,10-tetrahydro-6H-azepino[2,1-b]quinazoline-3-carboxamide Formula: C23H22N4O2S MolecularWeight: 418.51138

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)C(=O)N5CCCCCC5=N4

Isomeric SMILES

CCN(C1=NC2=CC=CC=C2S1)C(=O)C3=CC4=C(C=C3)C(=O)N5CCCCCC5=N4

InChI

InChI=1S/C23H22N4O2S/c1-2-26(23-25-17-8-5-6-9-19(17)30-23)21(28)15-11-12-16-18(14-15)24-20-10-4-3-7-13-27(20)22(16)29/h5-6,8-9,11-12,14H,2-4,7,10,13H2,1H3