1-[(E)-[2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methyl-phenyl]methylideneamino]-3-phenyl-thiourea

Systemtic Name: 1-[(E)-[2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methyl-phenyl]methylideneamino]-3-phenyl-thiourea Openeye Name: 1-[(E)-[2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methyl-phenyl]methyleneamino]-3-phenyl-thiourea CAS Name: 1-[(E)-[2-[(4,6-dimethoxy-2-pyrimidinyl)oxy]-6-methylphenyl]methylideneamino]-3-phenylthiourea IUPAC Name: 1-[(E)-[2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methylphenyl]methylideneamino]-3-phenylthiourea Traditional Name: 1-[(E)-[2-(4,6-dimethoxypyrimidin-2-yl)oxy-6-methyl-benzylidene]amino]-3-phenyl-thiourea Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)OC2=NC(=CC(=N2)OC)OC)C=NNC(=S)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=CC=C1)OC2=NC(=CC(=N2)OC)OC)/C=N/NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C21H21N5O3S/c1-14-8-7-11-17(29-20-24-18(27-2)12-19(25-20)28-3)16(14)13-22-26-21(30)23-15-9-5-4-6-10-15/h4-13H,1-3H3,(H2,23,26,30)/b22-13+