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

Systemtic Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-oxidanylidene-4-thiophen-2-yl-butanamide Openeye Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-thiazol-2-yl]-4-oxo-4-(2-thienyl)butanamide CAS Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-2-thiazolyl]-4-oxo-4-thiophen-2-ylbutanamide IUPAC Name: N-[5-(1,3-benzodioxol-5-ylmethyl)-4-methyl-1,3-thiazol-2-yl]-4-oxo-4-thiophen-2-ylbutanamide Traditional Name: 4-keto-N-(4-methyl-5-piperonyl-thiazol-2-yl)-4-(2-thienyl)butyramide Formula: C20H18N2O4S2 MolecularWeight: 414.49792

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)CCC(=O)C2=CC=CS2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)CCC(=O)C2=CC=CS2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C20H18N2O4S2/c1-12-18(10-13-4-6-15-16(9-13)26-11-25-15)28-20(21-12)22-19(24)7-5-14(23)17-3-2-8-27-17/h2-4,6,8-9H,5,7,10-11H2,1H3,(H,21,22,24)