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

Systemtic Name: 1-[(E)-[2-butyl-6-(4,6-dimethoxypyrimidin-2-yl)oxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[2-butyl-6-(4,6-dimethoxypyrimidin-2-yl)oxy-phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[2-butyl-6-[(4,6-dimethoxy-2-pyrimidinyl)oxy]phenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[2-butyl-6-(4,6-dimethoxypyrimidin-2-yl)oxyphenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[2-butyl-6-(4,6-dimethoxypyrimidin-2-yl)oxy-benzylidene]amino]thiourea Formula: C21H27N5O3S MolecularWeight: 429.53578

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(C(=CC=C1)OC2=NC(=CC(=N2)OC)OC)C=NNC(=S)NCC=C

Isomeric SMILES

CCCCC1=C(C(=CC=C1)OC2=NC(=CC(=N2)OC)OC)/C=N/NC(=S)NCC=C

InChI

InChI=1S/C21H27N5O3S/c1-5-7-9-15-10-8-11-17(16(15)14-23-26-21(30)22-12-6-2)29-20-24-18(27-3)13-19(25-20)28-4/h6,8,10-11,13-14H,2,5,7,9,12H2,1,3-4H3,(H2,22,26,30)/b23-14+