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

Systemtic Name: N-[(6R)-6-ethyl-3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[(6R)-6-ethyl-3-(m-tolylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[(6R)-6-ethyl-3-[(3-methylanilino)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(6R)-6-ethyl-3-[(3-methylphenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[(6R)-6-ethyl-3-(m-tolylcarbamoyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC(=C3)C)NC(=O)C4=CC=NN4C

Isomeric SMILES

CC[C@@H]1CCC2=C(C1)SC(=C2C(=O)NC3=CC=CC(=C3)C)NC(=O)C4=CC=NN4C

InChI

InChI=1S/C23H26N4O2S/c1-4-15-8-9-17-19(13-15)30-23(26-21(28)18-10-11-24-27(18)3)20(17)22(29)25-16-7-5-6-14(2)12-16/h5-7,10-12,15H,4,8-9,13H2,1-3H3,(H,25,29)(H,26,28)/t15-/m1/s1