2-(cyclohexylamino)-3-[(cyclohexylamino)methylidene]pyrido[1,2-a]pyrimidin-5-ium-4-one

Systemtic Name: 2-(cyclohexylamino)-3-[(cyclohexylamino)methylidene]pyrido[1,2-a]pyrimidin-5-ium-4-one Openeye Name: 2-(cyclohexylamino)-3-[(cyclohexylamino)methylene]pyrido[1,2-a]pyrimidin-5-ium-4-one CAS Name: 2-(cyclohexylamino)-3-[(cyclohexylamino)methylidene]-4-pyrido[1,2-a]pyrimidin-5-iumone IUPAC Name: 2-(cyclohexylamino)-3-[(cyclohexylamino)methylidene]pyrido[1,2-a]pyrimidin-5-ium-4-one Traditional Name: 2-(cyclohexylamino)-3-[(cyclohexylamino)methylene]pyrido[1,2-a]pyrimidin-5-ium-4-one Formula: C21H29N4O+ MolecularWeight: 353.48116

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC=C2C(=NC3=CC=CC=[N+]3C2=O)NC4CCCCC4

Isomeric SMILES

C1CCC(CC1)NC=C2C(=NC3=CC=CC=[N+]3C2=O)NC4CCCCC4

InChI

InChI=1S/C21H28N4O/c26-21-18(15-22-16-9-3-1-4-10-16)20(23-17-11-5-2-6-12-17)24-19-13-7-8-14-25(19)21/h7-8,13-17H,1-6,9-12H2,(H,22,23,26)/p+1