S-butyl (E)-3-[(3,4-dichlorophenyl)methoxycarbonylamino]but-2-enethioate

Systemtic Name: S-butyl (E)-3-[(3,4-dichlorophenyl)methoxycarbonylamino]but-2-enethioate Openeye Name: S-butyl (E)-3-[(3,4-dichlorophenyl)methoxycarbonylamino]but-2-enethioate CAS Name: (E)-3-[[(3,4-dichlorophenyl)methoxy-oxomethyl]amino]-2-butenethioic acid S-butyl ester IUPAC Name: S-butyl (E)-3-[(3,4-dichlorophenyl)methoxycarbonylamino]but-2-enethioate Traditional Name: (E)-3-[(3,4-dichlorobenzyl)oxycarbonylamino]but-2-enethioic acid S-butyl ester Formula: C16H19Cl2NO3S MolecularWeight: 376.29796

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC(=O)C=C(C)NC(=O)OCC1=CC(=C(C=C1)Cl)Cl

Isomeric SMILES

CCCCSC(=O)/C=C(\C)/NC(=O)OCC1=CC(=C(C=C1)Cl)Cl

InChI

InChI=1S/C16H19Cl2NO3S/c1-3-4-7-23-15(20)8-11(2)19-16(21)22-10-12-5-6-13(17)14(18)9-12/h5-6,8-9H,3-4,7,10H2,1-2H3,(H,19,21)/b11-8+