N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-methyl-3-pyrrol-1-yl-benzamide

Systemtic Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-methyl-3-pyrrol-1-yl-benzamide Openeye Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-4-methyl-3-pyrrol-1-yl-benzamide CAS Name: N-[4-(1,3-benzodioxol-5-yl)-2-thiazolyl]-4-methyl-3-(1-pyrrolyl)benzamide IUPAC Name: N-[4-(1,3-benzodioxol-5-yl)-1,3-thiazol-2-yl]-4-methyl-3-pyrrol-1-ylbenzamide Traditional Name: N-[4-(1,3-benzodioxol-5-yl)thiazol-2-yl]-4-methyl-3-pyrrol-1-yl-benzamide Formula: C22H17N3O3S MolecularWeight: 403.45368

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)N5C=CC=C5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=NC(=CS2)C3=CC4=C(C=C3)OCO4)N5C=CC=C5

InChI

InChI=1S/C22H17N3O3S/c1-14-4-5-16(10-18(14)25-8-2-3-9-25)21(26)24-22-23-17(12-29-22)15-6-7-19-20(11-15)28-13-27-19/h2-12H,13H2,1H3,(H,23,24,26)