5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide

Systemtic Name: 5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide Openeye Name: 5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide CAS Name: 5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide IUPAC Name: 5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide Traditional Name: 5-(cycloheptylamino)-3-nitro-2-(1,3,4-thiadiazol-2-yl)benzamide Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC2=CC(=C(C(=C2)C(=O)N)C3=NN=CS3)[N+](=O)[O-]

Isomeric SMILES

C1CCCC(CC1)NC2=CC(=C(C(=C2)C(=O)N)C3=NN=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3S/c17-15(22)12-7-11(19-10-5-3-1-2-4-6-10)8-13(21(23)24)14(12)16-20-18-9-25-16/h7-10,19H,1-6H2,(H2,17,22)