N-(1H-benzimidazol-2-ylmethyl)-13-oxidanylidene-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide

Systemtic Name: N-(1H-benzimidazol-2-ylmethyl)-13-oxidanylidene-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Openeye Name: N-(1H-benzimidazol-2-ylmethyl)-13-oxo-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide CAS Name: N-(1H-benzimidazol-2-ylmethyl)-13-oxo-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide IUPAC Name: N-(1H-benzimidazol-2-ylmethyl)-13-oxo-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Traditional Name: N-(1H-benzimidazol-2-ylmethyl)-13-keto-6,7,8,9,10,11-hexahydroazocino[2,1-b]quinazoline-3-carboxamide Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)NCC4=NC5=CC=CC=C5N4)CC1

Isomeric SMILES

C1CCCN2C(=NC3=C(C2=O)C=CC(=C3)C(=O)NCC4=NC5=CC=CC=C5N4)CC1

InChI

InChI=1S/C23H23N5O2/c29-22(24-14-20-25-17-7-4-5-8-18(17)26-20)15-10-11-16-19(13-15)27-21-9-3-1-2-6-12-28(21)23(16)30/h4-5,7-8,10-11,13H,1-3,6,9,12,14H2,(H,24,29)(H,25,26)