N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-(m-tolylcarbamoylamino)thiazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[[(3-methylanilino)-oxomethyl]amino]-5-thiazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-[(3-methylphenyl)carbamoylamino]-1,3-thiazole-5-carboxamide Traditional Name: 4-methyl-2-(m-tolylcarbamoylamino)-N-piperonyl-thiazole-5-carboxamide Formula: C21H20N4O4S MolecularWeight: 424.4729

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2=NC(=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2=NC(=C(S2)C(=O)NCC3=CC4=C(C=C3)OCO4)C

InChI

InChI=1S/C21H20N4O4S/c1-12-4-3-5-15(8-12)24-20(27)25-21-23-13(2)18(30-21)19(26)22-10-14-6-7-16-17(9-14)29-11-28-16/h3-9H,10-11H2,1-2H3,(H,22,26)(H2,23,24,25,27)