3-chloranyl-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-6-nitro-benzothiophene-2-carboxamide Formula: C17H15ClN4O3S2 MolecularWeight: 422.909

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)C3=C(C4=C(S3)C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN4O3S2/c18-13-11-7-6-10(22(24)25)8-12(11)26-14(13)15(23)19-17-21-20-16(27-17)9-4-2-1-3-5-9/h6-9H,1-5H2,(H,19,21,23)