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

Systemtic Name: N-[(6S)-3-aminocarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Openeye Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide CAS Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1-phenyl-4-pyrazolecarboxamide IUPAC Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1-phenylpyrazole-4-carboxamide Traditional Name: N-[(6S)-3-carbamoyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dimethyl-1-phenyl-pyrazole-4-carboxamide Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)N)NC(=O)C3=C(N(N=C3C)C4=CC=CC=C4)C

InChI

InChI=1S/C22H24N4O2S/c1-12-9-10-16-17(11-12)29-22(19(16)20(23)27)24-21(28)18-13(2)25-26(14(18)3)15-7-5-4-6-8-15/h4-8,12H,9-11H2,1-3H3,(H2,23,27)(H,24,28)/t12-/m0/s1