dodecyl N-[(2-aminophenyl)carbamothioyl]carbamate

Systemtic Name: dodecyl N-[(2-aminophenyl)carbamothioyl]carbamate Openeye Name: dodecyl N-[(2-aminophenyl)carbamothioyl]carbamate CAS Name: N-[(2-aminoanilino)-sulfanylidenemethyl]carbamic acid dodecyl ester IUPAC Name: dodecyl N-[(2-aminophenyl)carbamothioyl]carbamate Traditional Name: N-[(2-aminophenyl)thiocarbamoyl]carbamic acid lauryl ester Formula: C20H33N3O2S MolecularWeight: 379.55992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)NC(=S)NC1=CC=CC=C1N

Isomeric SMILES

CCCCCCCCCCCCOC(=O)NC(=S)NC1=CC=CC=C1N

InChI

InChI=1S/C20H33N3O2S/c1-2-3-4-5-6-7-8-9-10-13-16-25-20(24)23-19(26)22-18-15-12-11-14-17(18)21/h11-12,14-15H,2-10,13,16,21H2,1H3,(H2,22,23,24,26)