(2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propan-1-one

Systemtic Name: (2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Openeye Name: (2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propan-1-one CAS Name: (2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]-1-propanone IUPAC Name: (2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propan-1-one Traditional Name: (2S)-1-(3,4-dihydro-2H-quinolin-1-yl)-2-[(6-methyl-1H-benzimidazol-2-yl)thio]propan-1-one Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)SC(C)C(=O)N3CCCC4=CC=CC=C43

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)S[C@@H](C)C(=O)N3CCCC4=CC=CC=C43

InChI

InChI=1S/C20H21N3OS/c1-13-9-10-16-17(12-13)22-20(21-16)25-14(2)19(24)23-11-5-7-15-6-3-4-8-18(15)23/h3-4,6,8-10,12,14H,5,7,11H2,1-2H3,(H,21,22)/t14-/m0/s1