1-(5-chloranylthiophen-2-yl)-3-[(3-chlorophenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one

Systemtic Name: 1-(5-chloranylthiophen-2-yl)-3-[(3-chlorophenyl)amino]-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one Openeye Name: 3-(3-chloroanilino)-1-(5-chloro-2-thienyl)-2-pyridin-1-ium-1-yl-3-sulfanyl-prop-2-en-1-one CAS Name: 3-(3-chloroanilino)-1-(5-chloro-2-thiophenyl)-3-mercapto-2-(1-pyridin-1-iumyl)-2-propen-1-one IUPAC Name: 3-(3-chloroanilino)-1-(5-chlorothiophen-2-yl)-2-pyridin-1-ium-1-yl-3-sulfanylprop-2-en-1-one Traditional Name: 3-(3-chloroanilino)-1-(5-chloro-2-thienyl)-3-mercapto-2-pyridin-1-ium-1-yl-prop-2-en-1-one Formula: C18H13Cl2N2OS2+ MolecularWeight: 408.34462

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=C(NC2=CC(=CC=C2)Cl)S)C(=O)C3=CC=C(S3)Cl

Isomeric SMILES

C1=CC=[N+](C=C1)C(=C(NC2=CC(=CC=C2)Cl)S)C(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H12Cl2N2OS2/c19-12-5-4-6-13(11-12)21-18(24)16(22-9-2-1-3-10-22)17(23)14-7-8-15(20)25-14/h1-11H,(H-,21,23,24)/p+1