N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,4-dimethyl-benzamide

Systemtic Name: N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,4-dimethyl-benzamide Openeye Name: N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,4-dimethyl-benzamide CAS Name: N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,4-dimethylbenzamide IUPAC Name: N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3,4-dimethylbenzamide Traditional Name: N-[(5R)-3-cyano-5-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]-3,4-dimethyl-benzamide Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=C(C=C3)C)C)C#N

Isomeric SMILES

C[C@@H]1CCC2=C(C1)C(=C(S2)NC(=O)C3=CC(=C(C=C3)C)C)C#N

InChI

InChI=1S/C19H20N2OS/c1-11-4-7-17-15(8-11)16(10-20)19(23-17)21-18(22)14-6-5-12(2)13(3)9-14/h5-6,9,11H,4,7-8H2,1-3H3,(H,21,22)/t11-/m1/s1