(1S)-3-methylsulfanyl-1-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propan-1-amine

Systemtic Name: (1S)-3-methylsulfanyl-1-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propan-1-amine Openeye Name: (1S)-1-[1-[(4-isopropylphenyl)methyl]benzimidazol-2-yl]-3-methylsulfanyl-propan-1-amine CAS Name: (1S)-3-(methylthio)-1-[1-[(4-propan-2-ylphenyl)methyl]-2-benzimidazolyl]-1-propanamine IUPAC Name: (1S)-3-methylsulfanyl-1-[1-[(4-propan-2-ylphenyl)methyl]benzimidazol-2-yl]propan-1-amine Traditional Name: [(1S)-1-[1-(4-isopropylbenzyl)benzimidazol-2-yl]-3-(methylthio)propyl]amine Formula: C21H27N3S MolecularWeight: 353.52418

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2C(CCSC)N

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CN2C3=CC=CC=C3N=C2[C@H](CCSC)N

InChI

InChI=1S/C21H27N3S/c1-15(2)17-10-8-16(9-11-17)14-24-20-7-5-4-6-19(20)23-21(24)18(22)12-13-25-3/h4-11,15,18H,12-14,22H2,1-3H3/t18-/m0/s1