1-(6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-(3-methylsulfanylpropyl)thiourea

Systemtic Name: 1-(6-methyl-4-oxidanylidene-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-(3-methylsulfanylpropyl)thiourea Openeye Name: 1-(6-methyl-4-oxo-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-(3-methylsulfanylpropyl)thiourea CAS Name: 1-(6-methyl-4-oxo-5-phenyl-3-thieno[2,3-d]pyrimidinyl)-3-[3-(methylthio)propyl]thiourea IUPAC Name: 1-(6-methyl-4-oxo-5-phenylthieno[2,3-d]pyrimidin-3-yl)-3-(3-methylsulfanylpropyl)thiourea Traditional Name: 1-(4-keto-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-3-yl)-3-[3-(methylthio)propyl]thiourea Formula: C18H20N4OS3 MolecularWeight: 404.5726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(S1)N=CN(C2=O)NC(=S)NCCCSC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C2=C(S1)N=CN(C2=O)NC(=S)NCCCSC)C3=CC=CC=C3

InChI

InChI=1S/C18H20N4OS3/c1-12-14(13-7-4-3-5-8-13)15-16(26-12)20-11-22(17(15)23)21-18(24)19-9-6-10-25-2/h3-5,7-8,11H,6,9-10H2,1-2H3,(H2,19,21,24)