ethyl 4-[[4-[(5-methylsulfanylthiophen-2-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[(5-methylsulfanylthiophen-2-yl)carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-[(5-methylsulfanylthiophene-2-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[[[5-(methylthio)-2-thiophenyl]-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[(5-methylsulfanylthiophene-2-carbonyl)amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[[5-(methylthio)thiophene-2-carbonyl]amino]isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C20H30N4O4S2 MolecularWeight: 454.6066

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CC=C(S3)SC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CC=C(S3)SC

InChI

InChI=1S/C20H30N4O4S2/c1-3-28-19(27)24-12-6-14(7-13-24)22-18(26)20(8-10-21-11-9-20)23-17(25)15-4-5-16(29-2)30-15/h4-5,14,21H,3,6-13H2,1-2H3,(H,22,26)(H,23,25)