7-(2-azanylphenoxy)-N-[bis(azanyl)methylidene]-1,4-dimethyl-indole-2-carboxamide; methanesulfonic acid

Systemtic Name: 7-(2-azanylphenoxy)-N-[bis(azanyl)methylidene]-1,4-dimethyl-indole-2-carboxamide; methanesulfonic acid Openeye Name: 7-(2-aminophenoxy)-N-(diaminomethylene)-1,4-dimethyl-indole-2-carboxamide; methanesulfonic acid CAS Name: 7-(2-aminophenoxy)-N-(diaminomethylidene)-1,4-dimethyl-2-indolecarboxamide; methanesulfonic acid IUPAC Name: 7-(2-aminophenoxy)-N-(diaminomethylidene)-1,4-dimethylindole-2-carboxamide; methanesulfonic acid Traditional Name: 7-(2-aminophenoxy)-N-(diaminomethylene)-1,4-dimethyl-indole-2-carboxamide; mesylic acid Formula: C20H27N5O8S2 MolecularWeight: 529.58708

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(N(C2=C(C=C1)OC3=CC=CC=C3N)C)C(=O)N=C(N)N.CS(=O)(=O)O.CS(=O)(=O)O

Isomeric SMILES

CC1=C2C=C(N(C2=C(C=C1)OC3=CC=CC=C3N)C)C(=O)N=C(N)N.CS(=O)(=O)O.CS(=O)(=O)O

InChI

InChI=1S/C18H19N5O2.2CH4O3S/c1-10-7-8-15(25-14-6-4-3-5-12(14)19)16-11(10)9-13(23(16)2)17(24)22-18(20)21;2*1-5(2,3)4/h3-9H,19H2,1-2H3,(H4,20,21,22,24);2*1H3,(H,2,3,4)