N-[bis(azanyl)methylidene]-4-chloranyl-1-methyl-6-[3-(pyrrolidin-1-ylmethyl)phenoxy]indole-2-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-chloranyl-1-methyl-6-[3-(pyrrolidin-1-ylmethyl)phenoxy]indole-2-carboxamide Openeye Name: 4-chloro-N-(diaminomethylene)-1-methyl-6-[3-(pyrrolidin-1-ylmethyl)phenoxy]indole-2-carboxamide CAS Name: 4-chloro-N-(diaminomethylidene)-1-methyl-6-[3-(1-pyrrolidinylmethyl)phenoxy]-2-indolecarboxamide IUPAC Name: 4-chloro-N-(diaminomethylidene)-1-methyl-6-[3-(pyrrolidin-1-ylmethyl)phenoxy]indole-2-carboxamide Traditional Name: 4-chloro-N-(diaminomethylene)-1-methyl-6-[3-(pyrrolidinomethyl)phenoxy]indole-2-carboxamide Formula: C22H24ClN5O2 MolecularWeight: 425.91126

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC(=CC(=C2C=C1C(=O)N=C(N)N)Cl)OC3=CC=CC(=C3)CN4CCCC4

Isomeric SMILES

CN1C2=CC(=CC(=C2C=C1C(=O)N=C(N)N)Cl)OC3=CC=CC(=C3)CN4CCCC4

InChI

InChI=1S/C22H24ClN5O2/c1-27-19-11-16(10-18(23)17(19)12-20(27)21(29)26-22(24)25)30-15-6-4-5-14(9-15)13-28-7-2-3-8-28/h4-6,9-12H,2-3,7-8,13H2,1H3,(H4,24,25,26,29)