(phenylmethyl) N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate

Systemtic Name: (phenylmethyl) N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate Openeye Name: benzyl N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate CAS Name: N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate Traditional Name: N-[4-[4-(2-thiocarbamoylphenyl)phenyl]butyl]carbamic acid benzyl ester Formula: C25H26N2O2S MolecularWeight: 418.55114

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NCCCCC2=CC=C(C=C2)C3=CC=CC=C3C(=S)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NCCCCC2=CC=C(C=C2)C3=CC=CC=C3C(=S)N

InChI

InChI=1S/C25H26N2O2S/c26-24(30)23-12-5-4-11-22(23)21-15-13-19(14-16-21)8-6-7-17-27-25(28)29-18-20-9-2-1-3-10-20/h1-5,9-16H,6-8,17-18H2,(H2,26,30)(H,27,28)