1-[2-(2-dimethylaminoethyloxy)-5-ethynyl-phenyl]-3-(5-methylpyrazin-2-yl)urea

Systemtic Name: 1-[2-(2-dimethylaminoethyloxy)-5-ethynyl-phenyl]-3-(5-methylpyrazin-2-yl)urea Openeye Name: 1-[2-(2-dimethylaminoethyloxy)-5-ethynyl-phenyl]-3-(5-methylpyrazin-2-yl)urea CAS Name: 1-[2-(2-dimethylaminoethyloxy)-5-ethynylphenyl]-3-(5-methyl-2-pyrazinyl)urea IUPAC Name: 1-[2-(2-dimethylaminoethyloxy)-5-ethynylphenyl]-3-(5-methylpyrazin-2-yl)urea Traditional Name: 1-[2-(2-dimethylaminoethyloxy)-5-ethynyl-phenyl]-3-(5-methylpyrazin-2-yl)urea Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=N1)NC(=O)NC2=C(C=CC(=C2)C#C)OCCN(C)C

Isomeric SMILES

CC1=CN=C(C=N1)NC(=O)NC2=C(C=CC(=C2)C#C)OCCN(C)C

InChI

InChI=1S/C18H21N5O2/c1-5-14-6-7-16(25-9-8-23(3)4)15(10-14)21-18(24)22-17-12-19-13(2)11-20-17/h1,6-7,10-12H,8-9H2,2-4H3,(H2,20,21,22,24)