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

Systemtic Name: methyl 5-methyl-2-[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]ethanoylamino]-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylate CAS Name: 5-methyl-2-[[2-[methyl-[(1-methyl-4-pyrazolyl)methyl]amino]-1-oxoethyl]amino]-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]-4-phenylthiophene-3-carboxylate Traditional Name: 5-methyl-2-[[2-[methyl-[(1-methylpyrazol-4-yl)methyl]amino]acetyl]amino]-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C21H24N4O3S MolecularWeight: 412.50526

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CN(C)CC2=CN(N=C2)C)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CN(C)CC2=CN(N=C2)C)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C21H24N4O3S/c1-14-18(16-8-6-5-7-9-16)19(21(27)28-4)20(29-14)23-17(26)13-24(2)11-15-10-22-25(3)12-15/h5-10,12H,11,13H2,1-4H3,(H,23,26)