N-carbamimidoyl-N-methyl-6-[2-(pyrrolidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide

Systemtic Name: N-carbamimidoyl-N-methyl-6-[2-(pyrrolidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Openeye Name: N-carbamimidoyl-N-methyl-6-[2-(pyrrolidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide CAS Name: N-carbamimidoyl-N-methyl-6-[2-(1-pyrrolidinylmethyl)phenoxy]-1H-indole-2-carboxamide IUPAC Name: N-carbamimidoyl-N-methyl-6-[2-(pyrrolidin-1-ylmethyl)phenoxy]-1H-indole-2-carboxamide Traditional Name: N-amidino-N-methyl-6-[2-(pyrrolidinomethyl)phenoxy]-1H-indole-2-carboxamide Formula: C22H25N5O2 MolecularWeight: 391.4662

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)C1=CC2=C(N1)C=C(C=C2)OC3=CC=CC=C3CN4CCCC4)C(=N)N

Isomeric SMILES

CN(C(=O)C1=CC2=C(N1)C=C(C=C2)OC3=CC=CC=C3CN4CCCC4)C(=N)N

InChI

InChI=1S/C22H25N5O2/c1-26(22(23)24)21(28)19-12-15-8-9-17(13-18(15)25-19)29-20-7-3-2-6-16(20)14-27-10-4-5-11-27/h2-3,6-9,12-13,25H,4-5,10-11,14H2,1H3,(H3,23,24)