3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-sulfanylidene-pyrimido[4,5-d]pyrimidin-4-one hydrochloride

Systemtic Name: 3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-sulfanylidene-pyrimido[4,5-d]pyrimidin-4-one hydrochloride Openeye Name: 3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-thioxo-pyrimido[4,5-d]pyrimidin-4-one hydrochloride CAS Name: 3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-sulfanylidene-4-pyrimido[4,5-d]pyrimidinone hydrochloride IUPAC Name: 3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-sulfanylidenepyrimido[4,5-d]pyrimidin-4-one hydrochloride Traditional Name: 3-(2-dimethylaminoethyl)-7-methyl-1-phenyl-2-thioxo-pyrimido[4,5-d]pyrimidin-4-one hydrochloride Formula: C17H20ClN5OS MolecularWeight: 377.8916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=C2C(=N1)N(C(=S)N(C2=O)CCN(C)C)C3=CC=CC=C3.Cl

Isomeric SMILES

CC1=NC=C2C(=N1)N(C(=S)N(C2=O)CCN(C)C)C3=CC=CC=C3.Cl

InChI

InChI=1S/C17H19N5OS.ClH/c1-12-18-11-14-15(19-12)22(13-7-5-4-6-8-13)17(24)21(16(14)23)10-9-20(2)3;/h4-8,11H,9-10H2,1-3H3;1H