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

Systemtic Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)propanamide Openeye Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)propanamide CAS Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(3-nitrophenyl)propanamide IUPAC Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(3-nitrophenyl)propanamide Traditional Name: 2-[[5-(tert-butylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(3-nitrophenyl)propionamide Formula: C15H19N5O3S2 MolecularWeight: 381.47306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC(C)(C)C

Isomeric SMILES

CC(C(=O)NC1=CC(=CC=C1)[N+](=O)[O-])SC2=NN=C(S2)NC(C)(C)C

InChI

InChI=1S/C15H19N5O3S2/c1-9(24-14-19-18-13(25-14)17-15(2,3)4)12(21)16-10-6-5-7-11(8-10)20(22)23/h5-9H,1-4H3,(H,16,21)(H,17,18)