methyl 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-oxidanylidene-4H-imidazol-4-yl]ethanoate

Systemtic Name: methyl 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-oxidanylidene-4H-imidazol-4-yl]ethanoate Openeye Name: methyl 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-oxo-4H-imidazol-4-yl]acetate CAS Name: 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-oxo-4H-imidazol-4-yl]acetic acid methyl ester IUPAC Name: methyl 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-oxo-4H-imidazol-4-yl]acetate Traditional Name: 2-[2-(cyanoamino)-1-[2-(1H-indol-3-yl)ethyl]-5-keto-2-imidazolin-4-yl]acetic acid methyl ester Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1C(=O)N(C(=N1)NC#N)CCC2=CNC3=CC=CC=C32

Isomeric SMILES

COC(=O)CC1C(=O)N(C(=N1)NC#N)CCC2=CNC3=CC=CC=C32

InChI

InChI=1S/C17H17N5O3/c1-25-15(23)8-14-16(24)22(17(21-14)20-10-18)7-6-11-9-19-13-5-3-2-4-12(11)13/h2-5,9,14,19H,6-8H2,1H3,(H,20,21)