2-[(2-bromophenyl)carbamoyl-butan-2-yl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide

Systemtic Name: 2-[(2-bromophenyl)carbamoyl-butan-2-yl-amino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)ethanamide Openeye Name: N-benzyl-2-[(2-bromophenyl)carbamoyl-sec-butyl-amino]-N-(2-thienylmethyl)acetamide CAS Name: 2-[[(2-bromoanilino)-oxomethyl]-butan-2-ylamino]-N-(phenylmethyl)-N-(thiophen-2-ylmethyl)acetamide IUPAC Name: N-benzyl-2-[(2-bromophenyl)carbamoyl-butan-2-ylamino]-N-(thiophen-2-ylmethyl)acetamide Traditional Name: N-benzyl-2-[(2-bromophenyl)carbamoyl-sec-butyl-amino]-N-(2-thenyl)acetamide Formula: C25H28BrN3O2S MolecularWeight: 514.47772

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=CC=C3Br

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2)C(=O)NC3=CC=CC=C3Br

InChI

InChI=1S/C25H28BrN3O2S/c1-3-19(2)29(25(31)27-23-14-8-7-13-22(23)26)18-24(30)28(17-21-12-9-15-32-21)16-20-10-5-4-6-11-20/h4-15,19H,3,16-18H2,1-2H3,(H,27,31)