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

Systemtic Name: N-butan-2-yl-2-[[(4-methoxyphenyl)carbamoyl-propan-2-yl-amino]methyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[[isopropyl-[(4-methoxyphenyl)carbamoyl]amino]methyl]-N-sec-butyl-thiazole-4-carboxamide CAS Name: N-butan-2-yl-2-[[[(4-methoxyanilino)-oxomethyl]-propan-2-ylamino]methyl]-4-thiazolecarboxamide IUPAC Name: N-butan-2-yl-2-[[(4-methoxyphenyl)carbamoyl-propan-2-ylamino]methyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[[isopropyl-[(4-methoxyphenyl)carbamoyl]amino]methyl]-N-sec-butyl-thiazole-4-carboxamide Formula: C20H28N4O3S MolecularWeight: 404.52632

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC=C(C=C2)OC

Isomeric SMILES

CCC(C)NC(=O)C1=CSC(=N1)CN(C(C)C)C(=O)NC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H28N4O3S/c1-6-14(4)21-19(25)17-12-28-18(23-17)11-24(13(2)3)20(26)22-15-7-9-16(27-5)10-8-15/h7-10,12-14H,6,11H2,1-5H3,(H,21,25)(H,22,26)