2-[(3-bromophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide

Systemtic Name: 2-[(3-bromophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide Openeye Name: 2-[(3-bromophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propanamide CAS Name: 2-[[(3-bromoanilino)-oxomethyl]amino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide IUPAC Name: 2-[(3-bromophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenylpropanamide Traditional Name: 2-[(3-bromophenyl)carbamoylamino]-N-[5-(4-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-phenyl-propionamide Formula: C25H22BrN5O3S MolecularWeight: 552.44288

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)NC4=CC(=CC=C4)Br

Isomeric SMILES

COC1=CC=C(C=C1)C2=NN=C(S2)NC(=O)C(CC3=CC=CC=C3)NC(=O)NC4=CC(=CC=C4)Br

InChI

InChI=1S/C25H22BrN5O3S/c1-34-20-12-10-17(11-13-20)23-30-31-25(35-23)29-22(32)21(14-16-6-3-2-4-7-16)28-24(33)27-19-9-5-8-18(26)15-19/h2-13,15,21H,14H2,1H3,(H2,27,28,33)(H,29,31,32)