(4-imidazol-1-ylphenyl)methyl-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-yl-ethyl]azanium

Systemtic Name: (4-imidazol-1-ylphenyl)methyl-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-yl-ethyl]azanium Openeye Name: (4-imidazol-1-ylphenyl)methyl-[(2R)-2-(1H-indol-3-yl)-2-(2-thienyl)ethyl]ammonium CAS Name: [4-(1-imidazolyl)phenyl]methyl-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]ammonium IUPAC Name: (4-imidazol-1-ylphenyl)methyl-[(2R)-2-(1H-indol-3-yl)-2-thiophen-2-ylethyl]azanium Traditional Name: (4-imidazol-1-ylbenzyl)-[(2R)-2-(1H-indol-3-yl)-2-(2-thienyl)ethyl]ammonium Formula: C24H23N4S+ MolecularWeight: 399.53122

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C(C[NH2+]CC3=CC=C(C=C3)N4C=CN=C4)C5=CC=CS5

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)[C@H](C[NH2+]CC3=CC=C(C=C3)N4C=CN=C4)C5=CC=CS5

InChI

InChI=1S/C24H22N4S/c1-2-5-23-20(4-1)21(16-27-23)22(24-6-3-13-29-24)15-26-14-18-7-9-19(10-8-18)28-12-11-25-17-28/h1-13,16-17,22,26-27H,14-15H2/p+1/t22-/m0/s1