S-pent-4-ynyl N-(2-ethenylphenyl)-N-(phenylmethyl)carbamothioate

Systemtic Name: S-pent-4-ynyl N-(2-ethenylphenyl)-N-(phenylmethyl)carbamothioate Openeye Name: S-pent-4-ynyl N-benzyl-N-(2-vinylphenyl)carbamothioate CAS Name: N-(2-ethenylphenyl)-N-(phenylmethyl)carbamothioic acid S-pent-4-ynyl ester IUPAC Name: S-pent-4-ynyl N-benzyl-N-(2-ethenylphenyl)carbamothioate Traditional Name: N-benzyl-N-(2-vinylphenyl)thiocarbamic acid S-pent-4-ynyl ester Formula: C21H21NOS MolecularWeight: 335.46254

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Descriptors Computed from Structure

Canonical SMILES:

C=CC1=CC=CC=C1N(CC2=CC=CC=C2)C(=O)SCCCC#C

Isomeric SMILES

C=CC1=CC=CC=C1N(CC2=CC=CC=C2)C(=O)SCCCC#C

InChI

InChI=1S/C21H21NOS/c1-3-5-11-16-24-21(23)22(17-18-12-7-6-8-13-18)20-15-10-9-14-19(20)4-2/h1,4,6-10,12-15H,2,5,11,16-17H2