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

Systemtic Name: N-[(6R)-6-ethyl-3-morpholin-4-ylcarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Openeye Name: N-[(6R)-6-ethyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide CAS Name: N-[(6R)-6-ethyl-3-[4-morpholinyl(oxo)methyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methyl-3-pyrazolecarboxamide IUPAC Name: N-[(6R)-6-ethyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-methylpyrazole-3-carboxamide Traditional Name: N-[(6R)-6-ethyl-3-(morpholine-4-carbonyl)-4,5,6,7-tetrahydrobenzothiophen-2-yl]-2-methyl-pyrazole-3-carboxamide Formula: C20H26N4O3S MolecularWeight: 402.51044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC2=C(C1)SC(=C2C(=O)N3CCOCC3)NC(=O)C4=CC=NN4C

Isomeric SMILES

CC[C@@H]1CCC2=C(C1)SC(=C2C(=O)N3CCOCC3)NC(=O)C4=CC=NN4C

InChI

InChI=1S/C20H26N4O3S/c1-3-13-4-5-14-16(12-13)28-19(22-18(25)15-6-7-21-23(15)2)17(14)20(26)24-8-10-27-11-9-24/h6-7,13H,3-5,8-12H2,1-2H3,(H,22,25)/t13-/m1/s1