N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-1,2,3-thiadiazole-4-carboxamide

Systemtic Name: N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-ethyl]-1,2,3-thiadiazole-4-carboxamide Openeye Name: N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-oxo-ethyl]thiadiazole-4-carboxamide CAS Name: N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-oxoethyl]-4-thiadiazolecarboxamide IUPAC Name: N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-oxoethyl]thiadiazole-4-carboxamide Traditional Name: N-(4-bromophenyl)-N-[2-(cyclohexylamino)-2-keto-ethyl]thiadiazole-4-carboxamide Formula: C17H19BrN4O2S MolecularWeight: 423.32736

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)CN(C2=CC=C(C=C2)Br)C(=O)C3=CSN=N3

Isomeric SMILES

C1CCC(CC1)NC(=O)CN(C2=CC=C(C=C2)Br)C(=O)C3=CSN=N3

InChI

InChI=1S/C17H19BrN4O2S/c18-12-6-8-14(9-7-12)22(17(24)15-11-25-21-20-15)10-16(23)19-13-4-2-1-3-5-13/h6-9,11,13H,1-5,10H2,(H,19,23)