1-[(E)-[2-[3-(4-butan-2-ylphenoxy)propoxy]-3-methoxy-phenyl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[2-[3-(4-butan-2-ylphenoxy)propoxy]-3-methoxy-phenyl]methylideneamino]thiourea Openeye Name: [(E)-[3-methoxy-2-[3-(4-sec-butylphenoxy)propoxy]phenyl]methyleneamino]thiourea CAS Name: [(E)-[2-[3-(4-butan-2-ylphenoxy)propoxy]-3-methoxyphenyl]methylideneamino]thiourea IUPAC Name: [(E)-[2-[3-(4-butan-2-ylphenoxy)propoxy]-3-methoxyphenyl]methylideneamino]thiourea Traditional Name: [(E)-[3-methoxy-2-[3-(4-sec-butylphenoxy)propoxy]benzylidene]amino]thiourea Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)OCCCOC2=C(C=CC=C2OC)C=NNC(=S)N

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)OCCCOC2=C(C=CC=C2OC)/C=N/NC(=S)N

InChI

InChI=1S/C22H29N3O3S/c1-4-16(2)17-9-11-19(12-10-17)27-13-6-14-28-21-18(15-24-25-22(23)29)7-5-8-20(21)26-3/h5,7-12,15-16H,4,6,13-14H2,1-3H3,(H3,23,25,29)/b24-15+