1-[(E)-(4-heptoxyphenyl)methylideneamino]-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-[(E)-(4-heptoxyphenyl)methylideneamino]-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-[(E)-(4-heptoxyphenyl)methyleneamino]-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-[(E)-(4-heptoxyphenyl)methylideneamino]-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-[(E)-(4-heptoxyphenyl)methylideneamino]-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-[(E)-(4-heptoxybenzylidene)amino]-3-p-anisyl-thiourea Formula: C23H31N3O2S MolecularWeight: 413.57614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C=NNC(=S)NCC2=CC=C(C=C2)OC

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)/C=N/NC(=S)NCC2=CC=C(C=C2)OC

InChI

InChI=1S/C23H31N3O2S/c1-3-4-5-6-7-16-28-22-14-10-20(11-15-22)18-25-26-23(29)24-17-19-8-12-21(27-2)13-9-19/h8-15,18H,3-7,16-17H2,1-2H3,(H2,24,26,29)/b25-18+