N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-4-methyl-2-(3-thienyl)thiazole-5-carboxamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-methyl-2-(3-thiophenyl)-5-thiazolecarboxamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-methyl-2-thiophen-3-yl-1,3-thiazole-5-carboxamide Traditional Name: 4-methyl-N-(4-methyl-5-piperonyl-thiazol-2-yl)-2-(3-thienyl)thiazole-5-carboxamide Formula: C21H17N3O3S3 MolecularWeight: 455.57298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C2=C(N=C(S2)C3=CSC=C3)C)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)C2=C(N=C(S2)C3=CSC=C3)C)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H17N3O3S3/c1-11-17(8-13-3-4-15-16(7-13)27-10-26-15)29-21(23-11)24-19(25)18-12(2)22-20(30-18)14-5-6-28-9-14/h3-7,9H,8,10H2,1-2H3,(H,23,24,25)