2-[(4-bromophenyl)carbamoyl-cyclopropyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[(4-bromophenyl)carbamoyl-cyclopropyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[(4-bromophenyl)carbamoyl-cyclopropyl-amino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methyl-2-thienyl)methyl]acetamide CAS Name: 2-[[(4-bromoanilino)-oxomethyl]-cyclopropylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methyl-2-thiophenyl)methyl]acetamide IUPAC Name: 2-[(4-bromophenyl)carbamoyl-cyclopropylamino]-N-[2-(3,4-dimethoxyphenyl)ethyl]-N-[(5-methylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[(4-bromophenyl)carbamoyl-cyclopropyl-amino]-N-homoveratryl-N-[(5-methyl-2-thienyl)methyl]acetamide Formula: C28H32BrN3O4S MolecularWeight: 586.54038

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(C3CC3)C(=O)NC4=CC=C(C=C4)Br

Isomeric SMILES

CC1=CC=C(S1)CN(CCC2=CC(=C(C=C2)OC)OC)C(=O)CN(C3CC3)C(=O)NC4=CC=C(C=C4)Br

InChI

InChI=1S/C28H32BrN3O4S/c1-19-4-12-24(37-19)17-31(15-14-20-5-13-25(35-2)26(16-20)36-3)27(33)18-32(23-10-11-23)28(34)30-22-8-6-21(29)7-9-22/h4-9,12-13,16,23H,10-11,14-15,17-18H2,1-3H3,(H,30,34)