methyl 4-[[4-[(E)-(propan-2-ylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-(propan-2-ylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-(isopropylcarbamothioylhydrazono)methyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-[[(propan-2-ylamino)-sulfanylidenemethyl]hydrazinylidene]methyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-(propan-2-ylcarbamothioylhydrazinylidene)methyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-(isopropylthiocarbamoylhydrazono)methyl]phenoxy]methyl]benzoic acid methyl ester Formula: C20H23N3O3S MolecularWeight: 385.47992

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NN=CC1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C)NC(=S)N/N=C/C1=CC=C(C=C1)OCC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C20H23N3O3S/c1-14(2)22-20(27)23-21-12-15-6-10-18(11-7-15)26-13-16-4-8-17(9-5-16)19(24)25-3/h4-12,14H,13H2,1-3H3,(H2,22,23,27)/b21-12+