1-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name: 1-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-phenyl]methylideneamino]-3-prop-2-enyl-thiourea Openeye Name: 1-allyl-3-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-phenyl]methyleneamino]thiourea CAS Name: 1-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea IUPAC Name: 1-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxyphenyl]methylideneamino]-3-prop-2-enylthiourea Traditional Name: 1-allyl-3-[(E)-[4-[2-(4-hexoxyphenoxy)ethoxy]-3-methoxy-benzylidene]amino]thiourea Formula: C26H35N3O4S MolecularWeight: 485.6388

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)C=NNC(=S)NCC=C)OC

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)OCCOC2=C(C=C(C=C2)/C=N/NC(=S)NCC=C)OC

InChI

InChI=1S/C26H35N3O4S/c1-4-6-7-8-16-31-22-10-12-23(13-11-22)32-17-18-33-24-14-9-21(19-25(24)30-3)20-28-29-26(34)27-15-5-2/h5,9-14,19-20H,2,4,6-8,15-18H2,1,3H3,(H2,27,29,34)/b28-20+