S-prop-2-enyl N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioate

Systemtic Name: S-prop-2-enyl N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioate Openeye Name: S-allyl N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioate CAS Name: N-[(E)-3-(4-chlorophenyl)-1-oxoprop-2-enyl]carbamothioic acid S-prop-2-enyl ester IUPAC Name: S-prop-2-enyl N-[(E)-3-(4-chlorophenyl)prop-2-enoyl]carbamothioate Traditional Name: N-[(E)-3-(4-chlorophenyl)acryloyl]thiocarbamic acid S-allyl ester Formula: C13H12ClNO2S MolecularWeight: 281.75788

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC(=O)NC(=O)C=CC1=CC=C(C=C1)Cl

Isomeric SMILES

C=CCSC(=O)NC(=O)/C=C/C1=CC=C(C=C1)Cl

InChI

InChI=1S/C13H12ClNO2S/c1-2-9-18-13(17)15-12(16)8-5-10-3-6-11(14)7-4-10/h2-8H,1,9H2,(H,15,16,17)/b8-5+