ethyl 5-azanyl-4-cyano-3-[[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]methyl]thiophene-2-carboxylate

Systemtic Name: ethyl 5-azanyl-4-cyano-3-[[methyl-[2-oxidanylidene-2-(propylamino)ethyl]amino]methyl]thiophene-2-carboxylate Openeye Name: ethyl 5-amino-4-cyano-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]thiophene-2-carboxylate CAS Name: 5-amino-4-cyano-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]-2-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-4-cyano-3-[[methyl-[2-oxo-2-(propylamino)ethyl]amino]methyl]thiophene-2-carboxylate Traditional Name: 5-amino-4-cyano-3-[[[2-keto-2-(propylamino)ethyl]-methyl-amino]methyl]thiophene-2-carboxylic acid ethyl ester Formula: C15H22N4O3S MolecularWeight: 338.42518

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)CN(C)CC1=C(SC(=C1C#N)N)C(=O)OCC

Isomeric SMILES

CCCNC(=O)CN(C)CC1=C(SC(=C1C#N)N)C(=O)OCC

InChI

InChI=1S/C15H22N4O3S/c1-4-6-18-12(20)9-19(3)8-11-10(7-16)14(17)23-13(11)15(21)22-5-2/h4-6,8-9,17H2,1-3H3,(H,18,20)