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

Systemtic Name: 2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[isopropyl(phenylcarbamoyl)amino]methyl]-N-(2-pyrrolidin-1-ylethyl)thiazole-4-carboxamide CAS Name: 2-[[[anilino(oxo)methyl]-propan-2-ylamino]methyl]-N-[2-(1-pyrrolidinyl)ethyl]-4-thiazolecarboxamide IUPAC Name: 2-[[phenylcarbamoyl(propan-2-yl)amino]methyl]-N-(2-pyrrolidin-1-ylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[isopropyl(phenylcarbamoyl)amino]methyl]-N-(2-pyrrolidinoethyl)thiazole-4-carboxamide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H29N5O2S/c1-16(2)26(21(28)23-17-8-4-3-5-9-17)14-19-24-18(15-29-19)20(27)22-10-13-25-11-6-7-12-25/h3-5,8-9,15-16H,6-7,10-14H2,1-2H3,(H,22,27)(H,23,28)