ethyl 4-[[4-[[4-(4-chlorophenyl)sulfanylthiophen-3-yl]carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-[[4-(4-chlorophenyl)sulfanylthiophen-3-yl]carbonylamino]piperidin-4-yl]carbonylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-[[4-(4-chlorophenyl)sulfanylthiophene-3-carbonyl]amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate CAS Name: 4-[[[4-[[[4-[(4-chlorophenyl)thio]-3-thiophenyl]-oxomethyl]amino]-4-piperidinyl]-oxomethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-[[4-(4-chlorophenyl)sulfanylthiophene-3-carbonyl]amino]piperidine-4-carbonyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[4-[[4-[(4-chlorophenyl)thio]thiophene-3-carbonyl]amino]isonipecotoyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C25H31ClN4O4S2 MolecularWeight: 551.12104

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CSC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)C2(CCNCC2)NC(=O)C3=CSC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C25H31ClN4O4S2/c1-2-34-24(33)30-13-7-18(8-14-30)28-23(32)25(9-11-27-12-10-25)29-22(31)20-15-35-16-21(20)36-19-5-3-17(26)4-6-19/h3-6,15-16,18,27H,2,7-14H2,1H3,(H,28,32)(H,29,31)