5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 5-[(2-cyclobutyl-3H-benzimidazol-5-yl)sulfonyl]-1,2,3,4-tetrahydroisoquinoline Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)C4=CC=CC5=C4CCNC5

Isomeric SMILES

C1CC(C1)C2=NC3=C(N2)C=C(C=C3)S(=O)(=O)C4=CC=CC5=C4CCNC5

InChI

InChI=1S/C20H21N3O2S/c24-26(25,19-6-2-5-14-12-21-10-9-16(14)19)15-7-8-17-18(11-15)23-20(22-17)13-3-1-4-13/h2,5-8,11,13,21H,1,3-4,9-10,12H2,(H,22,23)