1-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-(phenylmethyl)thiourea

Systemtic Name: 1-[(E)-(3-iodanyl-5-methoxy-4-phenylmethoxy-phenyl)methylideneamino]-3-(phenylmethyl)thiourea Openeye Name: 1-benzyl-3-[(E)-(4-benzyloxy-3-iodo-5-methoxy-phenyl)methyleneamino]thiourea CAS Name: 1-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]-3-(phenylmethyl)thiourea IUPAC Name: 1-benzyl-3-[(E)-(3-iodo-5-methoxy-4-phenylmethoxyphenyl)methylideneamino]thiourea Traditional Name: 1-[(E)-(4-benzoxy-3-iodo-5-methoxy-benzylidene)amino]-3-benzyl-thiourea Formula: C23H22IN3O2S MolecularWeight: 531.40915

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=S)NCC2=CC=CC=C2)I)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=S)NCC2=CC=CC=C2)I)OCC3=CC=CC=C3

InChI

InChI=1S/C23H22IN3O2S/c1-28-21-13-19(12-20(24)22(21)29-16-18-10-6-3-7-11-18)15-26-27-23(30)25-14-17-8-4-2-5-9-17/h2-13,15H,14,16H2,1H3,(H2,25,27,30)/b26-15+