N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethoxyphenyl)carbamoylamino]-3-methyl-pentanamide

Systemtic Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethoxyphenyl)carbamoylamino]-3-methyl-pentanamide Openeye Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethoxyphenyl)carbamoylamino]-3-methyl-pentanamide CAS Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[[(2-ethoxyanilino)-oxomethyl]amino]-3-methylpentanamide IUPAC Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-2-[(2-ethoxyphenyl)carbamoylamino]-3-methylpentanamide Traditional Name: N-[5-(4-bromophenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-(o-phenetylcarbamoylamino)valeramide Formula: C23H26BrN5O3S MolecularWeight: 532.45324

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)NC(=O)NC3=CC=CC=C3OCC

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC=C(C=C2)Br)NC(=O)NC3=CC=CC=C3OCC

InChI

InChI=1S/C23H26BrN5O3S/c1-4-14(3)19(26-22(31)25-17-8-6-7-9-18(17)32-5-2)20(30)27-23-29-28-21(33-23)15-10-12-16(24)13-11-15/h6-14,19H,4-5H2,1-3H3,(H2,25,26,31)(H,27,29,30)