1-[[2-(4-chlorophenyl)sulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methylamino]urea

Systemtic Name: 1-[[2-(4-chlorophenyl)sulfanyl-4-oxidanylidene-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methylamino]urea Openeye Name: [[2-(4-chlorophenyl)sulfanyl-4-oxo-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methylamino]urea CAS Name: [[2-[(4-chlorophenyl)thio]-4-oxo-3-pyrido[1,2-a]pyrimidin-5-iumylidene]methylamino]urea IUPAC Name: [[2-(4-chlorophenyl)sulfanyl-4-oxopyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methylamino]urea Traditional Name: [[2-[(4-chlorophenyl)thio]-4-keto-pyrido[1,2-a]pyrimidin-5-ium-3-ylidene]methylamino]urea Formula: C16H13ClN5O2S+ MolecularWeight: 374.82472

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+]2C(=C1)N=C(C(=CNNC(=O)N)C2=O)SC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=[N+]2C(=C1)N=C(C(=CNNC(=O)N)C2=O)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H12ClN5O2S/c17-10-4-6-11(7-5-10)25-14-12(9-19-21-16(18)24)15(23)22-8-2-1-3-13(22)20-14/h1-9H,(H3,18,21,24)/p+1