ethyl 5-aminocarbonyl-4-methyl-2-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 5-aminocarbonyl-4-methyl-2-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: ethyl 5-carbamoyl-4-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]thiophene-3-carboxylate CAS Name: 5-carbamoyl-4-methyl-2-[[2-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-1-oxoethyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-carbamoyl-4-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]thiophene-3-carboxylate Traditional Name: 5-carbamoyl-4-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C17H23N5O4S MolecularWeight: 393.46062

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CN(C)CC2=CN(N=C2)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)N)NC(=O)CN(C)CC2=CN(N=C2)C

InChI

InChI=1S/C17H23N5O4S/c1-5-26-17(25)13-10(2)14(15(18)24)27-16(13)20-12(23)9-21(3)7-11-6-19-22(4)8-11/h6,8H,5,7,9H2,1-4H3,(H2,18,24)(H,20,23)