1-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxy-phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[2-[3-(4-tert-butylphenoxy)propoxy]-3-methoxy-benzylidene]amino]thiourea Formula: C25H33N3O3S MolecularWeight: 455.61282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCOC2=C(C=CC=C2OC)C=NNC(=S)NCC=C

Isomeric SMILES

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

InChI

InChI=1S/C25H33N3O3S/c1-6-15-26-24(32)28-27-18-19-9-7-10-22(29-5)23(19)31-17-8-16-30-21-13-11-20(12-14-21)25(2,3)4/h6-7,9-14,18H,1,8,15-17H2,2-5H3,(H2,26,28,32)/b27-18+