N-[bis(azanyl)methylidene]-4-chloranyl-7-[3-(dimethylaminomethyl)phenoxy]-1-methyl-indole-2-carboxamide

Systemtic Name: N-[bis(azanyl)methylidene]-4-chloranyl-7-[3-(dimethylaminomethyl)phenoxy]-1-methyl-indole-2-carboxamide Openeye Name: 4-chloro-N-(diaminomethylene)-7-[3-(dimethylaminomethyl)phenoxy]-1-methyl-indole-2-carboxamide CAS Name: 4-chloro-N-(diaminomethylidene)-7-[3-(dimethylaminomethyl)phenoxy]-1-methyl-2-indolecarboxamide IUPAC Name: 4-chloro-N-(diaminomethylidene)-7-[3-(dimethylaminomethyl)phenoxy]-1-methylindole-2-carboxamide Traditional Name: 4-chloro-N-(diaminomethylene)-7-[3-(dimethylaminomethyl)phenoxy]-1-methyl-indole-2-carboxamide Formula: C20H22ClN5O2 MolecularWeight: 399.87398

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CC2=C(C=CC(=C21)OC3=CC=CC(=C3)CN(C)C)Cl)C(=O)N=C(N)N

Isomeric SMILES

CN1C(=CC2=C(C=CC(=C21)OC3=CC=CC(=C3)CN(C)C)Cl)C(=O)N=C(N)N

InChI

InChI=1S/C20H22ClN5O2/c1-25(2)11-12-5-4-6-13(9-12)28-17-8-7-15(21)14-10-16(26(3)18(14)17)19(27)24-20(22)23/h4-10H,11H2,1-3H3,(H4,22,23,24,27)