1-[(E)-(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-(3-chloranyl-5-ethoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-(4-benzyloxy-3-chloro-5-ethoxy-phenyl)methyleneamino]thiourea CAS Name: 1-[(E)-(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-(3-chloro-5-ethoxy-4-phenylmethoxyphenyl)methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-(4-benzoxy-3-chloro-5-ethoxy-benzylidene)amino]thiourea Formula: C20H22ClN3O2S MolecularWeight: 403.92558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C(=CC(=C1)C=NNC(=S)NCC=C)Cl)OCC2=CC=CC=C2

Isomeric SMILES

CCOC1=C(C(=CC(=C1)/C=N/NC(=S)NCC=C)Cl)OCC2=CC=CC=C2

InChI

InChI=1S/C20H22ClN3O2S/c1-3-10-22-20(27)24-23-13-16-11-17(21)19(18(12-16)25-4-2)26-14-15-8-6-5-7-9-15/h3,5-9,11-13H,1,4,10,14H2,2H3,(H2,22,24,27)/b23-13+