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

Systemtic Name: 2-[[(3-chlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3-chlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isopentyl-thiazole-4-carboxamide CAS Name: 2-[[[(3-chloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-(3-methylbutyl)-4-thiazolecarboxamide IUPAC Name: 2-[[(3-chlorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3-chlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isoamyl-thiazole-4-carboxamide Formula: C20H27ClN4O2S MolecularWeight: 422.97198

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(C)CCNC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC(=CC=C2)Cl

InChI

InChI=1S/C20H27ClN4O2S/c1-13(2)8-9-22-19(26)17-12-28-18(24-17)11-25(14(3)4)20(27)23-16-7-5-6-15(21)10-16/h5-7,10,12-14H,8-9,11H2,1-4H3,(H,22,26)(H,23,27)