N-(2-methyl-3-nitro-phenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide

Systemtic Name: N-(2-methyl-3-nitro-phenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanamide Openeye Name: 2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-(2-methyl-3-nitro-phenyl)acetamide CAS Name: N-(2-methyl-3-nitrophenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]thio]acetamide IUPAC Name: N-(2-methyl-3-nitrophenyl)-2-[[5-(propan-2-ylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide Traditional Name: 2-[[5-(isopropylamino)-1,3,4-thiadiazol-2-yl]thio]-N-(2-methyl-3-nitro-phenyl)acetamide Formula: C14H17N5O3S2 MolecularWeight: 367.44648

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NC(C)C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])NC(=O)CSC2=NN=C(S2)NC(C)C

InChI

InChI=1S/C14H17N5O3S2/c1-8(2)15-13-17-18-14(24-13)23-7-12(20)16-10-5-4-6-11(9(10)3)19(21)22/h4-6,8H,7H2,1-3H3,(H,15,17)(H,16,20)