methyl 2-[2-[3-[(aminocarbonylamino)methyl]piperidin-1-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[2-[3-[(aminocarbonylamino)methyl]piperidin-1-yl]ethanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 4,5-dimethyl-2-[[2-[3-(ureidomethyl)-1-piperidyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 2-[[2-[3-[(carbamoylamino)methyl]-1-piperidinyl]-1-oxoethyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[3-[(carbamoylamino)methyl]piperidin-1-yl]acetyl]amino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[2-[3-(ureidomethyl)piperidino]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C17H26N4O4S MolecularWeight: 382.47774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCCC(C2)CNC(=O)N)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CN2CCCC(C2)CNC(=O)N)C

InChI

InChI=1S/C17H26N4O4S/c1-10-11(2)26-15(14(10)16(23)25-3)20-13(22)9-21-6-4-5-12(8-21)7-19-17(18)24/h12H,4-9H2,1-3H3,(H,20,22)(H3,18,19,24)