1-prop-2-enyl-3-[[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]carbamothioylamino]thiourea

Systemtic Name: 1-prop-2-enyl-3-[[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]carbamothioylamino]thiourea Openeye Name: 1-allyl-3-[[4-(2-thioxo-3H-1,3,4-oxadiazol-5-yl)phenyl]carbamothioylamino]thiourea CAS Name: 1-prop-2-enyl-3-[[sulfanylidene-[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)anilino]methyl]amino]thiourea IUPAC Name: 1-prop-2-enyl-3-[[4-(2-sulfanylidene-3H-1,3,4-oxadiazol-5-yl)phenyl]carbamothioylamino]thiourea Traditional Name: 1-allyl-3-[[4-(2-thioxo-3H-1,3,4-oxadiazol-5-yl)phenyl]thiocarbamoylamino]thiourea Formula: C13H14N6OS3 MolecularWeight: 366.48486

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Descriptors Computed from Structure

Canonical SMILES:

C=CCNC(=S)NNC(=S)NC1=CC=C(C=C1)C2=NNC(=S)O2

Isomeric SMILES

C=CCNC(=S)NNC(=S)NC1=CC=C(C=C1)C2=NNC(=S)O2

InChI

InChI=1S/C13H14N6OS3/c1-2-7-14-11(21)17-18-12(22)15-9-5-3-8(4-6-9)10-16-19-13(23)20-10/h2-6H,1,7H2,(H,19,23)(H2,14,17,21)(H2,15,18,22)