3-butyl-1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-1-methyl-thiourea

Systemtic Name: 3-butyl-1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methylideneamino]-1-methyl-thiourea Openeye Name: 3-butyl-1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxy-phenyl]methyleneamino]-1-methyl-thiourea CAS Name: 3-butyl-1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-1-methylthiourea IUPAC Name: 3-butyl-1-[(E)-[4-[(4-chlorophenyl)methoxy]-3-methoxyphenyl]methylideneamino]-1-methylthiourea Traditional Name: 3-butyl-1-[(E)-[4-(4-chlorobenzyl)oxy-3-methoxy-benzylidene]amino]-1-methyl-thiourea Formula: C21H26ClN3O2S MolecularWeight: 419.96804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)N(C)N=CC1=CC(=C(C=C1)OCC2=CC=C(C=C2)Cl)OC

Isomeric SMILES

CCCCNC(=S)N(C)/N=C/C1=CC(=C(C=C1)OCC2=CC=C(C=C2)Cl)OC

InChI

InChI=1S/C21H26ClN3O2S/c1-4-5-12-23-21(28)25(2)24-14-17-8-11-19(20(13-17)26-3)27-15-16-6-9-18(22)10-7-16/h6-11,13-14H,4-5,12,15H2,1-3H3,(H,23,28)/b24-14+