2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-1-propan-2-ylsulfonyl-propan-1-amine

Systemtic Name: 2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-1-propan-2-ylsulfonyl-propan-1-amine Openeye Name: 1-isopropylsulfonyl-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-propan-1-amine CAS Name: 2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-1-propan-2-ylsulfonyl-1-propanamine IUPAC Name: 2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-1-propan-2-ylsulfonylpropan-1-amine Traditional Name: [1-isopropylsulfonyl-2-[2-(4-methoxyphenyl)-3H-benzimidazol-5-yl]-2-methyl-propyl]amine Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)S(=O)(=O)C(C(C)(C)C1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)OC)N

Isomeric SMILES

CC(C)S(=O)(=O)C(C(C)(C)C1=CC2=C(C=C1)N=C(N2)C3=CC=C(C=C3)OC)N

InChI

InChI=1S/C21H27N3O3S/c1-13(2)28(25,26)20(22)21(3,4)15-8-11-17-18(12-15)24-19(23-17)14-6-9-16(27-5)10-7-14/h6-13,20H,22H2,1-5H3,(H,23,24)