1-methyl-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-(3-phenylprop-2-ynyl)urea

Systemtic Name: 1-methyl-1-[(4-oxidanylidene-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-(3-phenylprop-2-ynyl)urea Openeye Name: 1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-(3-phenylprop-2-ynyl)urea CAS Name: 1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-(3-phenylprop-2-ynyl)urea IUPAC Name: 1-methyl-1-[(4-oxo-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-3-(3-phenylprop-2-ynyl)urea Traditional Name: 1-[(4-keto-1H-thieno[3,2-d]pyrimidin-2-yl)methyl]-1-methyl-3-(3-phenylprop-2-ynyl)urea Formula: C18H16N4O2S MolecularWeight: 352.41024

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)NCC#CC3=CC=CC=C3

Isomeric SMILES

CN(CC1=NC(=O)C2=C(N1)C=CS2)C(=O)NCC#CC3=CC=CC=C3

InChI

InChI=1S/C18H16N4O2S/c1-22(12-15-20-14-9-11-25-16(14)17(23)21-15)18(24)19-10-5-8-13-6-3-2-4-7-13/h2-4,6-7,9,11H,10,12H2,1H3,(H,19,24)(H,20,21,23)