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

Systemtic Name: 2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Openeye Name: 2-[[5-(2-furylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide CAS Name: 2-[[5-(2-furanylmethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)propanamide IUPAC Name: 2-[[5-(furan-2-ylmethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(4-nitrophenyl)propanamide Traditional Name: 2-[[5-(2-furfurylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(4-nitrophenyl)propionamide Formula: C16H15N5O4S2 MolecularWeight: 405.4514

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NN=C(S2)NCC3=CC=CO3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)[N+](=O)[O-])SC2=NN=C(S2)NCC3=CC=CO3

InChI

InChI=1S/C16H15N5O4S2/c1-10(14(22)18-11-4-6-12(7-5-11)21(23)24)26-16-20-19-15(27-16)17-9-13-3-2-8-25-13/h2-8,10H,9H2,1H3,(H,17,19)(H,18,22)