pentyl 2-[(4-dimethylaminophenyl)carbamothioylamino]ethanoate

Systemtic Name: pentyl 2-[(4-dimethylaminophenyl)carbamothioylamino]ethanoate Openeye Name: pentyl 2-[(4-dimethylaminophenyl)carbamothioylamino]acetate CAS Name: 2-[[[4-(dimethylamino)anilino]-sulfanylidenemethyl]amino]acetic acid pentyl ester IUPAC Name: pentyl 2-[(4-dimethylaminophenyl)carbamothioylamino]acetate Traditional Name: 2-[(4-dimethylaminophenyl)thiocarbamoylamino]acetic acid amyl ester Formula: C16H25N3O2S MolecularWeight: 323.4536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)CNC(=S)NC1=CC=C(C=C1)N(C)C

Isomeric SMILES

CCCCCOC(=O)CNC(=S)NC1=CC=C(C=C1)N(C)C

InChI

InChI=1S/C16H25N3O2S/c1-4-5-6-11-21-15(20)12-17-16(22)18-13-7-9-14(10-8-13)19(2)3/h7-10H,4-6,11-12H2,1-3H3,(H2,17,18,22)