5-[3-[(2-chlorophenyl)methoxy]prop-2-ynylsulfanyl]-1,3-dimethyl-pyrimidine-2,4-dione

Systemtic Name: 5-[3-[(2-chlorophenyl)methoxy]prop-2-ynylsulfanyl]-1,3-dimethyl-pyrimidine-2,4-dione Openeye Name: 5-[3-[(2-chlorophenyl)methoxy]prop-2-ynylsulfanyl]-1,3-dimethyl-pyrimidine-2,4-dione CAS Name: 5-[3-[(2-chlorophenyl)methoxy]prop-2-ynylthio]-1,3-dimethylpyrimidine-2,4-dione IUPAC Name: 5-[3-[(2-chlorophenyl)methoxy]prop-2-ynylsulfanyl]-1,3-dimethylpyrimidine-2,4-dione Traditional Name: 5-[3-(2-chlorobenzyl)oxyprop-2-ynylthio]-1,3-dimethyl-pyrimidine-2,4-quinone Formula: C16H15ClN2O3S MolecularWeight: 350.8199

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=O)N(C1=O)C)SCC#COCC2=CC=CC=C2Cl

Isomeric SMILES

CN1C=C(C(=O)N(C1=O)C)SCC#COCC2=CC=CC=C2Cl

InChI

InChI=1S/C16H15ClN2O3S/c1-18-10-14(15(20)19(2)16(18)21)23-9-5-8-22-11-12-6-3-4-7-13(12)17/h3-4,6-7,10H,9,11H2,1-2H3