2-[(4-bromophenyl)carbamoyl-butan-2-yl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[(4-bromophenyl)carbamoyl-butan-2-yl-amino]-N-[(3-methylthiophen-2-yl)methyl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[(4-bromophenyl)carbamoyl-sec-butyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(4-bromoanilino)-oxomethyl]-butan-2-ylamino]-N-[(3-methyl-2-thiophenyl)methyl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[(4-bromophenyl)carbamoyl-butan-2-ylamino]-N-[(3-methylthiophen-2-yl)methyl]acetamide Traditional Name: N-benzyl-2-[(4-bromophenyl)carbamoyl-sec-butyl-amino]-N-[(3-methyl-2-thienyl)methyl]acetamide Formula: C26H30BrN3O2S MolecularWeight: 528.5043

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CCC(C)N(CC(=O)N(CC1=CC=CC=C1)CC2=C(C=CS2)C)C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C26H30BrN3O2S/c1-4-20(3)30(26(32)28-23-12-10-22(27)11-13-23)18-25(31)29(16-21-8-6-5-7-9-21)17-24-19(2)14-15-33-24/h5-15,20H,4,16-18H2,1-3H3,(H,28,32)