N-[2-[5-[(4-acetamidophenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromanyl-benzamide

Systemtic Name: N-[2-[5-[(4-acetamidophenyl)carbonylamino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromanyl-benzamide Openeye Name: N-[2-[5-[(4-acetamidobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromo-benzamide CAS Name: N-[2-[5-[[(4-acetamidophenyl)-oxomethyl]amino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromobenzamide IUPAC Name: N-[2-[5-[(4-acetamidobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromobenzamide Traditional Name: N-[2-[5-[(4-acetamidobenzoyl)amino]-1,3,4-thiadiazol-2-yl]ethyl]-3-bromo-benzamide Formula: C20H18BrN5O3S MolecularWeight: 488.35762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CCNC(=O)C3=CC(=CC=C3)Br

Isomeric SMILES

CC(=O)NC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)CCNC(=O)C3=CC(=CC=C3)Br

InChI

InChI=1S/C20H18BrN5O3S/c1-12(27)23-16-7-5-13(6-8-16)19(29)24-20-26-25-17(30-20)9-10-22-18(28)14-3-2-4-15(21)11-14/h2-8,11H,9-10H2,1H3,(H,22,28)(H,23,27)(H,24,26,29)