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

Systemtic Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-yl-amino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Openeye Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-propyl-thiazole-4-carboxamide CAS Name: 2-[[[(3,4-dichloroanilino)-oxomethyl]-propan-2-ylamino]methyl]-N-propyl-4-thiazolecarboxamide IUPAC Name: 2-[[(3,4-dichlorophenyl)carbamoyl-propan-2-ylamino]methyl]-N-propyl-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(3,4-dichlorophenyl)carbamoyl-isopropyl-amino]methyl]-N-propyl-thiazole-4-carboxamide Formula: C18H22Cl2N4O2S MolecularWeight: 429.36388

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22Cl2N4O2S/c1-4-7-21-17(25)15-10-27-16(23-15)9-24(11(2)3)18(26)22-12-5-6-13(19)14(20)8-12/h5-6,8,10-11H,4,7,9H2,1-3H3,(H,21,25)(H,22,26)