N-carbamimidoyl-N-methyl-7-[2-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-N-methyl-7-[2-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Openeye Name: N-carbamimidoyl-N-methyl-7-[2-(1-piperidylmethyl)phenoxy]-1H-indole-2-carboxamide CAS Name: N-carbamimidoyl-N-methyl-7-[2-(1-piperidinylmethyl)phenoxy]-1H-indole-2-carboxamide IUPAC Name: N-carbamimidoyl-N-methyl-7-[2-(piperidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Traditional Name: N-amidino-N-methyl-7-[2-(piperidinomethyl)phenoxy]-1H-indole-2-carboxamide Formula: C23H27N5O2 MolecularWeight: 405.49278

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(N1)C(=CC=C2)OC3=CC=CC=C3CN4CCCCC4)C(=N)N

Isomeric SMILES

CN(C(=O)C1=CC2=C(N1)C(=CC=C2)OC3=CC=CC=C3CN4CCCCC4)C(=N)N

InChI

InChI=1S/C23H27N5O2/c1-27(23(24)25)22(29)18-14-16-9-7-11-20(21(16)26-18)30-19-10-4-3-8-17(19)15-28-12-5-2-6-13-28/h3-4,7-11,14,26H,2,5-6,12-13,15H2,1H3,(H3,24,25)