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

Systemtic Name: methyl 5-aminocarbonyl-4-methyl-2-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 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 methyl ester IUPAC Name: methyl 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 methyl ester Formula: C16H21N5O4S MolecularWeight: 379.43404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CN(N=C2)C)C(=O)N

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN(C)CC2=CN(N=C2)C)C(=O)N

InChI

InChI=1S/C16H21N5O4S/c1-9-12(16(24)25-4)15(26-13(9)14(17)23)19-11(22)8-20(2)6-10-5-18-21(3)7-10/h5,7H,6,8H2,1-4H3,(H2,17,23)(H,19,22)