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

Systemtic Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[(phenylmethyl)carbamoylamino]pentanamide Openeye Name: 2-(benzylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-pentanamide CAS Name: N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-2-[[oxo-[(phenylmethyl)amino]methyl]amino]pentanamide IUPAC Name: 2-(benzylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methylpentanamide Traditional Name: 2-(benzylcarbamoylamino)-N-[5-(3-methoxyphenyl)-1,3,4-thiadiazol-2-yl]-3-methyl-valeramide Formula: C23H27N5O3S MolecularWeight: 453.55718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCC(C)C(C(=O)NC1=NN=C(S1)C2=CC(=CC=C2)OC)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C23H27N5O3S/c1-4-15(2)19(25-22(30)24-14-16-9-6-5-7-10-16)20(29)26-23-28-27-21(32-23)17-11-8-12-18(13-17)31-3/h5-13,15,19H,4,14H2,1-3H3,(H2,24,25,30)(H,26,28,29)