N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide

Systemtic Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Openeye Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide CAS Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-cyclopropyl-2-phenyl-3-pyrazolecarboxamide IUPAC Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-5-cyclopropyl-2-phenylpyrazole-3-carboxamide Traditional Name: N-[(6S)-3-cyano-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-5-cyclopropyl-2-phenyl-pyrazole-3-carboxamide Formula: C23H22N4OS MolecularWeight: 402.51198

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=CC(=NN3C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C23H22N4OS/c1-14-7-10-17-18(13-24)23(29-21(17)11-14)25-22(28)20-12-19(15-8-9-15)26-27(20)16-5-3-2-4-6-16/h2-6,12,14-15H,7-11H2,1H3,(H,25,28)/t14-/m0/s1