5-(2-methyl-1,3-thiazol-4-yl)-N-[(4-pentoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(2-methyl-1,3-thiazol-4-yl)-N-[(4-pentoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide Openeye Name: 5-(2-methylthiazol-4-yl)-N-[(4-pentoxyphenyl)carbamothioyl]isoxazole-3-carboxamide CAS Name: 5-(2-methyl-4-thiazolyl)-N-[(4-pentoxyanilino)-sulfanylidenemethyl]-3-isoxazolecarboxamide IUPAC Name: 5-(2-methyl-1,3-thiazol-4-yl)-N-[(4-pentoxyphenyl)carbamothioyl]-1,2-oxazole-3-carboxamide Traditional Name: N-[(4-amoxyphenyl)thiocarbamoyl]-5-(2-methylthiazol-4-yl)isoxazole-3-carboxamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=NOC(=C2)C3=CSC(=N3)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=NOC(=C2)C3=CSC(=N3)C

InChI

InChI=1S/C20H22N4O3S2/c1-3-4-5-10-26-15-8-6-14(7-9-15)22-20(28)23-19(25)16-11-18(27-24-16)17-12-29-13(2)21-17/h6-9,11-12H,3-5,10H2,1-2H3,(H2,22,23,25,28)