(2R)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide

Systemtic Name: (2R)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide Openeye Name: (2R)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-6-methyl-2,3-dihydrobenzothiophene-2-carboxamide CAS Name: (2R)-N-[(1S)-1-[4-(1-imidazolyl)phenyl]ethyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide IUPAC Name: (2R)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-6-methyl-2,3-dihydro-1-benzothiophene-2-carboxamide Traditional Name: (2R)-N-[(1S)-1-(4-imidazol-1-ylphenyl)ethyl]-6-methyl-2,3-dihydrobenzothiophene-2-carboxamide Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(S2)C(=O)NC(C)C3=CC=C(C=C3)N4C=CN=C4)C=C1

Isomeric SMILES

CC1=CC2=C(C[C@@H](S2)C(=O)N[C@@H](C)C3=CC=C(C=C3)N4C=CN=C4)C=C1

InChI

InChI=1S/C21H21N3OS/c1-14-3-4-17-12-20(26-19(17)11-14)21(25)23-15(2)16-5-7-18(8-6-16)24-10-9-22-13-24/h3-11,13,15,20H,12H2,1-2H3,(H,23,25)/t15-,20+/m0/s1