1-[(E)-[3-methoxy-4-(2-phenylsulfanylethoxy)phenyl]methylideneamino]-3-(4-methylphenyl)thiourea

Systemtic Name: 1-[(E)-[3-methoxy-4-(2-phenylsulfanylethoxy)phenyl]methylideneamino]-3-(4-methylphenyl)thiourea Openeye Name: 1-[(E)-[3-methoxy-4-(2-phenylsulfanylethoxy)phenyl]methyleneamino]-3-(p-tolyl)thiourea CAS Name: 1-[(E)-[3-methoxy-4-[2-(phenylthio)ethoxy]phenyl]methylideneamino]-3-(4-methylphenyl)thiourea IUPAC Name: 1-[(E)-[3-methoxy-4-(2-phenylsulfanylethoxy)phenyl]methylideneamino]-3-(4-methylphenyl)thiourea Traditional Name: 1-[(E)-[3-methoxy-4-[2-(phenylthio)ethoxy]benzylidene]amino]-3-(p-tolyl)thiourea Formula: C24H25N3O2S2 MolecularWeight: 451.6042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NN=CC2=CC(=C(C=C2)OCCSC3=CC=CC=C3)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)N/N=C/C2=CC(=C(C=C2)OCCSC3=CC=CC=C3)OC

InChI

InChI=1S/C24H25N3O2S2/c1-18-8-11-20(12-9-18)26-24(30)27-25-17-19-10-13-22(23(16-19)28-2)29-14-15-31-21-6-4-3-5-7-21/h3-13,16-17H,14-15H2,1-2H3,(H2,26,27,30)/b25-17+