5-(2,4-dinitrophenyl)sulfanyl-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-(2,4-dinitrophenyl)sulfanyl-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Openeye Name: 5-(2,4-dinitrophenyl)sulfanyl-N-[2-(2-thienyl)ethyl]-1,3,4-thiadiazol-2-amine CAS Name: 5-[(2,4-dinitrophenyl)thio]-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine IUPAC Name: 5-(2,4-dinitrophenyl)sulfanyl-N-(2-thiophen-2-ylethyl)-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(2,4-dinitrophenyl)thio]-1,3,4-thiadiazol-2-yl]-[2-(2-thienyl)ethyl]amine Formula: C14H11N5O4S3 MolecularWeight: 409.46324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCNC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CSC(=C1)CCNC2=NN=C(S2)SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C14H11N5O4S3/c20-18(21)9-3-4-12(11(8-9)19(22)23)25-14-17-16-13(26-14)15-6-5-10-2-1-7-24-10/h1-4,7-8H,5-6H2,(H,15,16)