N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(3-methyl-2-oxidanylidene-benzimidazol-1-yl)propanamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(3-methyl-2-oxo-benzimidazol-1-yl)propanamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-3-(3-methyl-2-oxo-1-benzimidazolyl)propanamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-3-(3-methyl-2-oxobenzimidazol-1-yl)propanamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-3-(2-keto-3-methyl-benzimidazol-1-yl)propionamide Formula: C21H18N4O4S MolecularWeight: 422.45702

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CN1C2=CC=CC=C2N(C1=O)CCC(=O)NC3=NC(=CS3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C21H18N4O4S/c1-24-15-4-2-3-5-16(15)25(21(24)27)9-8-19(26)23-20-22-14(11-30-20)13-6-7-17-18(10-13)29-12-28-17/h2-7,10-11H,8-9,12H2,1H3,(H,22,23,26)