1-[(E)-[3-chloranyl-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[3-chloranyl-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylideneamino]thiourea Openeye Name: [(E)-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methyleneamino]thiourea CAS Name: [(E)-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylideneamino]thiourea IUPAC Name: [(E)-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)phenyl]methylideneamino]thiourea Traditional Name: [(E)-[3-chloro-5-methoxy-4-(2-phenoxyethoxy)benzylidene]amino]thiourea Formula: C17H18ClN3O3S MolecularWeight: 379.86112

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)C=NNC(=S)N)Cl)OCCOC2=CC=CC=C2

Isomeric SMILES

COC1=C(C(=CC(=C1)/C=N/NC(=S)N)Cl)OCCOC2=CC=CC=C2

InChI

InChI=1S/C17H18ClN3O3S/c1-22-15-10-12(11-20-21-17(19)25)9-14(18)16(15)24-8-7-23-13-5-3-2-4-6-13/h2-6,9-11H,7-8H2,1H3,(H3,19,21,25)/b20-11+