4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-yl-methyl]pyridin-1-ium-2-amine

Systemtic Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-yl-methyl]pyridin-1-ium-2-amine Openeye Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-(2-thienyl)methyl]pyridin-1-ium-2-amine CAS Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-ylmethyl]-2-pyridin-1-iumamine IUPAC Name: 4-methyl-N-[(S)-(2-methyl-1H-indol-3-yl)-thiophen-2-ylmethyl]pyridin-1-ium-2-amine Traditional Name: [(S)-(2-methyl-1H-indol-3-yl)-(2-thienyl)methyl]-(4-methylpyridin-1-ium-2-yl)amine Formula: C20H20N3S+ MolecularWeight: 334.4579

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=[NH+]C=C1)NC(C2=CC=CS2)C3=C(NC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=[NH+]C=C1)N[C@H](C2=CC=CS2)C3=C(NC4=CC=CC=C43)C

InChI

InChI=1S/C20H19N3S/c1-13-9-10-21-18(12-13)23-20(17-8-5-11-24-17)19-14(2)22-16-7-4-3-6-15(16)19/h3-12,20,22H,1-2H3,(H,21,23)/p+1/t20-/m1/s1