(5-chloranylthiophen-2-yl)methyl-methyl-[(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium

Systemtic Name: (5-chloranylthiophen-2-yl)methyl-methyl-[(6-methyl-4-oxidanylidene-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Openeye Name: (5-chloro-2-thienyl)methyl-methyl-[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium CAS Name: (5-chloro-2-thiophenyl)methyl-methyl-[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]ammonium IUPAC Name: (5-chlorothiophen-2-yl)methyl-methyl-[(6-methyl-4-oxo-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]azanium Traditional Name: (5-chloro-2-thienyl)methyl-[(4-keto-6-methyl-1H-pyrido[1,2-a]pyrimidin-5-ium-2-yl)methyl]-methyl-ammonium Formula: C16H18ClN3OS+2 MolecularWeight: 335.85162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+]2C(=CC=C1)NC(=CC2=O)C[NH+](C)CC3=CC=C(S3)Cl

Isomeric SMILES

CC1=[N+]2C(=CC=C1)NC(=CC2=O)C[NH+](C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C16H16ClN3OS/c1-11-4-3-5-15-18-12(8-16(21)20(11)15)9-19(2)10-13-6-7-14(17)22-13/h3-8H,9-10H2,1-2H3/p+2