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

Systemtic Name: tert-butyl N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate Openeye Name: tert-butyl N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate CAS Name: N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-(2-carbamothioylphenyl)phenyl]butyl]carbamate Traditional Name: N-[4-[4-(2-thiocarbamoylphenyl)phenyl]butyl]carbamic acid tert-butyl ester Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCCC1=CC=C(C=C1)C2=CC=CC=C2C(=S)N

Isomeric SMILES

CC(C)(C)OC(=O)NCCCCC1=CC=C(C=C1)C2=CC=CC=C2C(=S)N

InChI

InChI=1S/C22H28N2O2S/c1-22(2,3)26-21(25)24-15-7-6-8-16-11-13-17(14-12-16)18-9-4-5-10-19(18)20(23)27/h4-5,9-14H,6-8,15H2,1-3H3,(H2,23,27)(H,24,25)