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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CN(N=C2C)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CN(N=C2C)C)C(=O)N

InChI

InChI=1S/C17H23N5O4S/c1-9-13(17(25)26-5)16(27-14(9)15(18)24)19-12(23)8-21(3)6-11-7-22(4)20-10(11)2/h7H,6,8H2,1-5H3,(H2,18,24)(H,19,23)