ethyl 4-methyl-5-(methylcarbamoyl)-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidin-4-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]thiophene-3-carboxylate CAS Name: 4-methyl-5-(methylcarbamoyl)-2-[[oxo-[1-[(E)-1-oxo-3-phenylprop-2-enyl]-4-piperidinyl]methyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-methyl-5-(methylcarbamoyl)-2-[[1-[(E)-3-phenylprop-2-enoyl]piperidine-4-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 4-methyl-5-(methylcarbamoyl)-2-[[1-[(E)-3-phenylacryloyl]isonipecotoyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C25H29N3O5S MolecularWeight: 483.57986

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2CCN(CC2)C(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)NC)NC(=O)C2CCN(CC2)C(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H29N3O5S/c1-4-33-25(32)20-16(2)21(23(31)26-3)34-24(20)27-22(30)18-12-14-28(15-13-18)19(29)11-10-17-8-6-5-7-9-17/h5-11,18H,4,12-15H2,1-3H3,(H,26,31)(H,27,30)/b11-10+