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

Systemtic Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(2-pyrrolidin-1-ylethyl)thiazole-4-carboxamide CAS Name: 2-[[[(3,4-dichloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-[2-(1-pyrrolidinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-(2-pyrrolidinoethyl)thiazole-4-carboxamide Formula: C21H27Cl2N5O2S MolecularWeight: 484.44238

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27Cl2N5O2S/c1-14(2)28(21(30)25-15-5-6-16(22)17(23)11-15)12-19-26-18(13-31-19)20(29)24-7-10-27-8-3-4-9-27/h5-6,11,13-14H,3-4,7-10,12H2,1-2H3,(H,24,29)(H,25,30)