(3,4-dimethylphenyl)methyl N-[(phenylmethyl)carbamothioylamino]carbamate

Systemtic Name: (3,4-dimethylphenyl)methyl N-[(phenylmethyl)carbamothioylamino]carbamate Openeye Name: (3,4-dimethylphenyl)methyl N-(benzylcarbamothioylamino)carbamate CAS Name: N-[[[(phenylmethyl)amino]-sulfanylidenemethyl]amino]carbamic acid (3,4-dimethylphenyl)methyl ester IUPAC Name: (3,4-dimethylphenyl)methyl N-(benzylcarbamothioylamino)carbamate Traditional Name: N-(benzylthiocarbamoylamino)carbamic acid (3,4-dimethylbenzyl) ester Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)COC(=O)NNC(=S)NCC2=CC=CC=C2)C

Isomeric SMILES

CC1=C(C=C(C=C1)COC(=O)NNC(=S)NCC2=CC=CC=C2)C

InChI

InChI=1S/C18H21N3O2S/c1-13-8-9-16(10-14(13)2)12-23-18(22)21-20-17(24)19-11-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3,(H,21,22)(H2,19,20,24)