4-azanyl-9-(furan-2-ylmethyl)-N-(phenylmethyl)pyrimido[4,5-b]indole-2-carboxamide

Systemtic Name: 4-azanyl-9-(furan-2-ylmethyl)-N-(phenylmethyl)pyrimido[4,5-b]indole-2-carboxamide Openeye Name: 4-amino-N-benzyl-9-(2-furylmethyl)pyrimido[4,5-b]indole-2-carboxamide CAS Name: 4-amino-9-(2-furanylmethyl)-N-(phenylmethyl)-2-pyrimido[4,5-b]indolecarboxamide IUPAC Name: 4-amino-N-benzyl-9-(furan-2-ylmethyl)pyrimido[4,5-b]indole-2-carboxamide Traditional Name: 4-amino-N-benzyl-9-(2-furfuryl)pyrimid[4,5-b]indole-2-carboxamide Formula: C23H19N5O2 MolecularWeight: 397.42926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=NC3=C(C4=CC=CC=C4N3CC5=CC=CO5)C(=N2)N

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=NC3=C(C4=CC=CC=C4N3CC5=CC=CO5)C(=N2)N

InChI

InChI=1S/C23H19N5O2/c24-20-19-17-10-4-5-11-18(17)28(14-16-9-6-12-30-16)22(19)27-21(26-20)23(29)25-13-15-7-2-1-3-8-15/h1-12H,13-14H2,(H,25,29)(H2,24,26,27)