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2-cyanoethylsulfanyl-[(E)-phenethylideneamino]carbamic acid

2-cyanoethylsulfanyl-[(E)-phenethylideneamino]carbamic acid

Systemtic Name:2-cyanoethylsulfanyl-[(E)-phenethylideneamino]carbamic acid
Openeye Name:2-cyanoethylsulfanyl-[(E)-phenethylideneamino]carbamic acid
CAS Name:(2-cyanoethylthio)-[(E)-phenethylideneamino]carbamic acid
IUPAC Name:2-cyanoethylsulfanyl-[(E)-phenethylideneamino]carbamic acid
Traditional Name:(2-cyanoethylthio)-[(E)-phenethylideneamino]carbamic acid
Formula: C12H13N3O2S
MolecularWeight: 263.31552
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC=NN(C(=O)O)SCCC#N


Isomeric SMILES

C1=CC=C(C=C1)C/C=N/N(C(=O)O)SCCC#N


InChI

InChI=1S/C12H13N3O2S/c13-8-4-10-18-15(12(16)17)14-9-7-11-5-2-1-3-6-11/h1-3,5-6,9H,4,7,10H2,(H,16,17)/b14-9+


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