3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide

Systemtic Name: 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Openeye Name: 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide CAS Name: 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Traditional Name: 3-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)propionamide Formula: C13H15N5O3S2 MolecularWeight: 353.4199

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SCCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NN=C(S1)SCCC(=O)NC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H15N5O3S2/c1-2-14-12-16-17-13(23-12)22-8-7-11(19)15-9-3-5-10(6-4-9)18(20)21/h3-6H,2,7-8H2,1H3,(H,14,16)(H,15,19)