N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide

Systemtic Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Openeye Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dimethyl-isoxazole-4-carboxamide CAS Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-4-isoxazolecarboxamide IUPAC Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,5-dimethyl-1,2-oxazole-4-carboxamide Traditional Name: N-[(6S)-3-cyano-6-propyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,5-dimethyl-isoxazole-4-carboxamide Formula: C18H21N3O2S MolecularWeight: 343.44324

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(ON=C3C)C

Isomeric SMILES

CCC[C@H]1CCC2=C(C1)SC(=C2C#N)NC(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C18H21N3O2S/c1-4-5-12-6-7-13-14(9-19)18(24-15(13)8-12)20-17(22)16-10(2)21-23-11(16)3/h12H,4-8H2,1-3H3,(H,20,22)/t12-/m0/s1