2-[[(3-chlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[[(3-chlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3-chlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(2-pyrrolidin-1-ylethyl)thiazole-4-carboxamide CAS Name: 2-[[[(3-chloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-[2-(1-pyrrolidinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[[(3-chlorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3-chlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(2-pyrrolidinoethyl)thiazole-4-carboxamide Formula: C21H28ClN5O2S MolecularWeight: 449.99732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC1=NC(=CS1)C(=O)NCCN2CCCC2)C(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CC(C)N(CC1=NC(=CS1)C(=O)NCCN2CCCC2)C(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C21H28ClN5O2S/c1-15(2)27(21(29)24-17-7-5-6-16(22)12-17)13-19-25-18(14-30-19)20(28)23-8-11-26-9-3-4-10-26/h5-7,12,14-15H,3-4,8-11,13H2,1-2H3,(H,23,28)(H,24,29)