ethyl N-[3-[2-[(2-cyanophenyl)methylsulfanyl]ethylcarbamoyl]phenyl]carbamate

Systemtic Name: ethyl N-[3-[2-[(2-cyanophenyl)methylsulfanyl]ethylcarbamoyl]phenyl]carbamate Openeye Name: ethyl N-[3-[2-[(2-cyanophenyl)methylsulfanyl]ethylcarbamoyl]phenyl]carbamate CAS Name: N-[3-[[2-[(2-cyanophenyl)methylthio]ethylamino]-oxomethyl]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[2-[(2-cyanophenyl)methylsulfanyl]ethylcarbamoyl]phenyl]carbamate Traditional Name: N-[3-[2-[(2-cyanobenzyl)thio]ethylcarbamoyl]phenyl]carbamic acid ethyl ester Formula: C20H21N3O3S MolecularWeight: 383.46404

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=CC(=C1)C(=O)NCCSCC2=CC=CC=C2C#N

Isomeric SMILES

CCOC(=O)NC1=CC=CC(=C1)C(=O)NCCSCC2=CC=CC=C2C#N

InChI

InChI=1S/C20H21N3O3S/c1-2-26-20(25)23-18-9-5-8-15(12-18)19(24)22-10-11-27-14-17-7-4-3-6-16(17)13-21/h3-9,12H,2,10-11,14H2,1H3,(H,22,24)(H,23,25)