ethyl 3-[2-[[(cyanoamino)-phenylazanyl-methylidene]amino]ethyl]-5-methyl-1H-indole-2-carboxylate

Systemtic Name: ethyl 3-[2-[[(cyanoamino)-phenylazanyl-methylidene]amino]ethyl]-5-methyl-1H-indole-2-carboxylate Openeye Name: ethyl 3-[2-[[anilino-(cyanoamino)methylene]amino]ethyl]-5-methyl-1H-indole-2-carboxylate CAS Name: 3-[2-[[anilino-(cyanoamino)methylidene]amino]ethyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester IUPAC Name: ethyl 3-[2-[[anilino-(cyanoamino)methylidene]amino]ethyl]-5-methyl-1H-indole-2-carboxylate Traditional Name: 3-[2-[[anilino-(cyanoamino)methylene]amino]ethyl]-5-methyl-1H-indole-2-carboxylic acid ethyl ester Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CCN=C(NC#N)NC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C2=C(N1)C=CC(=C2)C)CCN=C(NC#N)NC3=CC=CC=C3

InChI

InChI=1S/C22H23N5O2/c1-3-29-21(28)20-17(18-13-15(2)9-10-19(18)27-20)11-12-24-22(25-14-23)26-16-7-5-4-6-8-16/h4-10,13,27H,3,11-12H2,1-2H3,(H2,24,25,26)