5-chloranyl-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylsulfonyl-pyrimidine-4-carboxamide

Systemtic Name: 5-chloranyl-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylsulfonyl-pyrimidine-4-carboxamide Openeye Name: 5-chloro-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-ethylsulfonyl-pyrimidine-4-carboxamide CAS Name: 5-chloro-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylsulfonyl-4-pyrimidinecarboxamide IUPAC Name: 5-chloro-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-ethylsulfonylpyrimidine-4-carboxamide Traditional Name: 5-chloro-2-esyl-N-[3-(ethylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyrimidine-4-carboxamide Formula: C18H21ClN4O4S2 MolecularWeight: 456.96674

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC

Isomeric SMILES

CCNC(=O)C1=C(SC2=C1CCCC2)NC(=O)C3=NC(=NC=C3Cl)S(=O)(=O)CC

InChI

InChI=1S/C18H21ClN4O4S2/c1-3-20-15(24)13-10-7-5-6-8-12(10)28-17(13)23-16(25)14-11(19)9-21-18(22-14)29(26,27)4-2/h9H,3-8H2,1-2H3,(H,20,24)(H,23,25)