1-(4-methoxyphenyl)-1,5-di(pyrrol-1-yl)pyrrol-1-ium-2-thiol

Systemtic Name: 1-(4-methoxyphenyl)-1,5-di(pyrrol-1-yl)pyrrol-1-ium-2-thiol Openeye Name: 1-(4-methoxyphenyl)-1,5-di(pyrrol-1-yl)pyrrol-1-ium-2-thiol CAS Name: 1-(4-methoxyphenyl)-1,5-bis(1-pyrrolyl)-2-pyrrol-1-iumthiol IUPAC Name: 1-(4-methoxyphenyl)-1,5-di(pyrrol-1-yl)pyrrol-1-ium-2-thiol Traditional Name: 1-(4-methoxyphenyl)-1,5-di(pyrrol-1-yl)pyrrol-1-ium-2-thiol Formula: C19H18N3OS+ MolecularWeight: 336.43072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)[N+]2(C(=CC=C2S)N3C=CC=C3)N4C=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)[N+]2(C(=CC=C2S)N3C=CC=C3)N4C=CC=C4

InChI

InChI=1S/C19H17N3OS/c1-23-17-8-6-16(7-9-17)22(21-14-4-5-15-21)18(10-11-19(22)24)20-12-2-3-13-20/h2-15H,1H3/p+1