methyl-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-(thiophen-3-ylmethyl)azanium

Systemtic Name: methyl-[(7-methyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-2-yl)methyl]-(thiophen-3-ylmethyl)azanium Openeye Name: methyl-[(7-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methyl]-(3-thienylmethyl)ammonium CAS Name: methyl-[(7-methyl-4-oxo-2-pyrido[1,2-a]pyrimidinyl)methyl]-(3-thiophenylmethyl)ammonium IUPAC Name: methyl-[(7-methyl-4-oxopyrido[1,2-a]pyrimidin-2-yl)methyl]-(thiophen-3-ylmethyl)azanium Traditional Name: (4-keto-7-methyl-pyrido[1,2-a]pyrimidin-2-yl)methyl-methyl-(3-thenyl)ammonium Formula: C16H18N3OS+ MolecularWeight: 300.39862

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN2C(=NC(=CC2=O)C[NH+](C)CC3=CSC=C3)C=C1

Isomeric SMILES

CC1=CN2C(=NC(=CC2=O)C[NH+](C)CC3=CSC=C3)C=C1

InChI

InChI=1S/C16H17N3OS/c1-12-3-4-15-17-14(7-16(20)19(15)8-12)10-18(2)9-13-5-6-21-11-13/h3-8,11H,9-10H2,1-2H3/p+1