1-[2-[4-[[2,5-bis(chloranyl)thiophen-3-yl]sulfonyl-ethyl-amino]piperidin-1-yl]ethyl]-3-(2,6-dimethylpyridin-4-yl)urea

Systemtic Name: 1-[2-[4-[[2,5-bis(chloranyl)thiophen-3-yl]sulfonyl-ethyl-amino]piperidin-1-yl]ethyl]-3-(2,6-dimethylpyridin-4-yl)urea Openeye Name: 1-[2-[4-[(2,5-dichloro-3-thienyl)sulfonyl-ethyl-amino]-1-piperidyl]ethyl]-3-(2,6-dimethyl-4-pyridyl)urea CAS Name: 1-[2-[4-[(2,5-dichloro-3-thiophenyl)sulfonyl-ethylamino]-1-piperidinyl]ethyl]-3-(2,6-dimethyl-4-pyridinyl)urea IUPAC Name: 1-[2-[4-[(2,5-dichlorothiophen-3-yl)sulfonyl-ethylamino]piperidin-1-yl]ethyl]-3-(2,6-dimethylpyridin-4-yl)urea Traditional Name: 1-[2-[4-[(2,5-dichloro-3-thienyl)sulfonyl-ethyl-amino]piperidino]ethyl]-3-(2,6-dimethyl-4-pyridyl)urea Formula: C21H29Cl2N5O3S2 MolecularWeight: 534.52266

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCN(CC1)CCNC(=O)NC2=CC(=NC(=C2)C)C)S(=O)(=O)C3=C(SC(=C3)Cl)Cl

Isomeric SMILES

CCN(C1CCN(CC1)CCNC(=O)NC2=CC(=NC(=C2)C)C)S(=O)(=O)C3=C(SC(=C3)Cl)Cl

InChI

InChI=1S/C21H29Cl2N5O3S2/c1-4-28(33(30,31)18-13-19(22)32-20(18)23)17-5-8-27(9-6-17)10-7-24-21(29)26-16-11-14(2)25-15(3)12-16/h11-13,17H,4-10H2,1-3H3,(H2,24,25,26,29)