N-[3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide

Systemtic Name: N-[3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide Openeye Name: N-[3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydrobenzothiophen-2-yl]-1-ethyl-pyrazole-3-carboxamide CAS Name: N-[3-[(2-ethoxyanilino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethyl-3-pyrazolecarboxamide IUPAC Name: N-[3-[(2-ethoxyphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-1-ethylpyrazole-3-carboxamide Traditional Name: 1-ethyl-N-[3-(o-phenetylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]pyrazole-3-carboxamide Formula: C23H26N4O3S MolecularWeight: 438.54254

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4OCC

Isomeric SMILES

CCN1C=CC(=N1)C(=O)NC2=C(C3=C(S2)CCCC3)C(=O)NC4=CC=CC=C4OCC

InChI

InChI=1S/C23H26N4O3S/c1-3-27-14-13-17(26-27)21(28)25-23-20(15-9-5-8-12-19(15)31-23)22(29)24-16-10-6-7-11-18(16)30-4-2/h6-7,10-11,13-14H,3-5,8-9,12H2,1-2H3,(H,24,29)(H,25,28)