1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]azanium

Systemtic Name: 1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: 1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium CAS Name: 1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: 1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: 1,3-benzothiazol-2-ylmethyl-[(R)-(4-ethylphenyl)-(2-thienyl)methyl]ammonium Formula: C21H21N2S2+ MolecularWeight: 365.53484

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N2S2/c1-2-15-9-11-16(12-10-15)21(19-8-5-13-24-19)22-14-20-23-17-6-3-4-7-18(17)25-20/h3-13,21-22H,2,14H2,1H3/p+1/t21-/m1/s1