[1-[[3-methoxy-4-(methoxymethoxy)phenyl]methylcarbamothioylamino]-3-phenyl-propyl] 2,2-dimethylpropanoate

Systemtic Name: [1-[[3-methoxy-4-(methoxymethoxy)phenyl]methylcarbamothioylamino]-3-phenyl-propyl] 2,2-dimethylpropanoate Openeye Name: [1-[[3-methoxy-4-(methoxymethoxy)phenyl]methylcarbamothioylamino]-3-phenyl-propyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [1-[[[[3-methoxy-4-(methoxymethoxy)phenyl]methylamino]-sulfanylidenemethyl]amino]-3-phenylpropyl] ester IUPAC Name: [1-[[3-methoxy-4-(methoxymethoxy)phenyl]methylcarbamothioylamino]-3-phenylpropyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [1-[[3-methoxy-4-(methoxymethoxy)benzyl]thiocarbamoylamino]-3-phenyl-propyl] ester Formula: C25H34N2O5S MolecularWeight: 474.61286

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC(CCC1=CC=CC=C1)NC(=S)NCC2=CC(=C(C=C2)OCOC)OC

Isomeric SMILES

CC(C)(C)C(=O)OC(CCC1=CC=CC=C1)NC(=S)NCC2=CC(=C(C=C2)OCOC)OC

InChI

InChI=1S/C25H34N2O5S/c1-25(2,3)23(28)32-22(14-12-18-9-7-6-8-10-18)27-24(33)26-16-19-11-13-20(31-17-29-4)21(15-19)30-5/h6-11,13,15,22H,12,14,16-17H2,1-5H3,(H2,26,27,33)