4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-nitro-N-propan-2-yl-benzamide

Systemtic Name: 4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-nitro-N-propan-2-yl-benzamide Openeye Name: 4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-N-isopropyl-3-nitro-benzamide CAS Name: 4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]-3-nitro-N-propan-2-ylbenzamide IUPAC Name: 4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]-3-nitro-N-propan-2-ylbenzamide Traditional Name: 4-[[5-(ethylamino)-1,3,4-thiadiazol-2-yl]thio]-N-isopropyl-3-nitro-benzamide Formula: C14H17N5O3S2 MolecularWeight: 367.44648

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=NN=C(S1)SC2=C(C=C(C=C2)C(=O)NC(C)C)[N+](=O)[O-]

Isomeric SMILES

CCNC1=NN=C(S1)SC2=C(C=C(C=C2)C(=O)NC(C)C)[N+](=O)[O-]

InChI

InChI=1S/C14H17N5O3S2/c1-4-15-13-17-18-14(24-13)23-11-6-5-9(7-10(11)19(21)22)12(20)16-8(2)3/h5-8H,4H2,1-3H3,(H,15,17)(H,16,20)