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

Systemtic Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isopentyl-thiazole-4-carboxamide CAS Name: 2-[[[(3,4-dichloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-(3-methylbutyl)-4-thiazolecarboxamide IUPAC Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-isoamyl-thiazole-4-carboxamide Formula: C20H26Cl2N4O2S MolecularWeight: 457.41704

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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(=C(C=C2)Cl)Cl

Isomeric SMILES

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

InChI

InChI=1S/C20H26Cl2N4O2S/c1-12(2)7-8-23-19(27)17-11-29-18(25-17)10-26(13(3)4)20(28)24-14-5-6-15(21)16(22)9-14/h5-6,9,11-13H,7-8,10H2,1-4H3,(H,23,27)(H,24,28)