5-[(2-methyl-3H-benzimidazol-5-yl)sulfanyl]-1,2,3,4-tetrahydroisoquinoline

Systemtic Name: 5-[(2-methyl-3H-benzimidazol-5-yl)sulfanyl]-1,2,3,4-tetrahydroisoquinoline Openeye Name: 5-[(2-methyl-3H-benzimidazol-5-yl)sulfanyl]-1,2,3,4-tetrahydroisoquinoline CAS Name: 5-[(2-methyl-3H-benzimidazol-5-yl)thio]-1,2,3,4-tetrahydroisoquinoline IUPAC Name: 5-[(2-methyl-3H-benzimidazol-5-yl)sulfanyl]-1,2,3,4-tetrahydroisoquinoline Traditional Name: 5-[(2-methyl-3H-benzimidazol-5-yl)thio]-1,2,3,4-tetrahydroisoquinoline Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC4=C3CCNC4

Isomeric SMILES

CC1=NC2=C(N1)C=C(C=C2)SC3=CC=CC4=C3CCNC4

InChI

InChI=1S/C17H17N3S/c1-11-19-15-6-5-13(9-16(15)20-11)21-17-4-2-3-12-10-18-8-7-14(12)17/h2-6,9,18H,7-8,10H2,1H3,(H,19,20)