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1-[(E)-[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

1-[(E)-[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylideneamino]-3-prop-2-enyl-thiourea

Systemtic Name:1-[(E)-[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methylideneamino]-3-prop-2-enyl-thiourea
Openeye Name:1-allyl-3-[(E)-[4-(2-hydroxyethylsulfanyl)-3-nitro-phenyl]methyleneamino]thiourea
CAS Name:1-[(E)-[4-(2-hydroxyethylthio)-3-nitrophenyl]methylideneamino]-3-prop-2-enylthiourea
IUPAC Name:1-[(E)-[4-(2-hydroxyethylsulfanyl)-3-nitrophenyl]methylideneamino]-3-prop-2-enylthiourea
Traditional Name:1-allyl-3-[(E)-[4-(2-hydroxyethylthio)-3-nitro-benzylidene]amino]thiourea
Formula: C13H16N4O3S2
MolecularWeight: 340.42114
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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NN=CC1=CC(=C(C=C1)SCCO)[N+](=O)[O-]


Isomeric SMILES

C=CCNC(=S)N/N=C/C1=CC(=C(C=C1)SCCO)[N+](=O)[O-]


InChI

InChI=1S/C13H16N4O3S2/c1-2-5-14-13(21)16-15-9-10-3-4-12(22-7-6-18)11(8-10)17(19)20/h2-4,8-9,18H,1,5-7H2,(H2,14,16,21)/b15-9+


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