(6S,7aR)-2-azanylidene-6-(2-methylbutan-2-yl)-N-phenyl-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carboxamide

Systemtic Name: (6S,7aR)-2-azanylidene-6-(2-methylbutan-2-yl)-N-phenyl-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carboxamide Openeye Name: (6S,7aR)-6-(1,1-dimethylpropyl)-2-imino-N-phenyl-5,6,7,7a-tetrahydro-4H-benzothiophene-3-carboxamide CAS Name: (6S,7aR)-2-imino-6-(2-methylbutan-2-yl)-N-phenyl-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carboxamide IUPAC Name: (6S,7aR)-2-imino-6-(2-methylbutan-2-yl)-N-phenyl-5,6,7,7a-tetrahydro-4H-1-benzothiophene-3-carboxamide Traditional Name: (6S,7aR)-6-tert-amyl-2-imino-N-phenyl-5,6,7,7a-tetrahydro-4H-benzothiophene-3-carboxamide Formula: C20H26N2OS MolecularWeight: 342.49824

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1CCC2=C(C(=N)SC2C1)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCC(C)(C)[C@H]1CCC2=C(C(=N)S[C@@H]2C1)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C20H26N2OS/c1-4-20(2,3)13-10-11-15-16(12-13)24-18(21)17(15)19(23)22-14-8-6-5-7-9-14/h5-9,13,16,21H,4,10-12H2,1-3H3,(H,22,23)/t13-,16+/m0/s1