N-(1,3-benzodioxol-5-yl)-2-methyl-2-[2-phenylethanoyl-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]propanamide

Systemtic Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[2-phenylethanoyl-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]propanamide Openeye Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-[(4-phenylthiazol-2-yl)methyl]amino]propanamide CAS Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(1-oxo-2-phenylethyl)-[(4-phenyl-2-thiazolyl)methyl]amino]propanamide IUPAC Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-[(4-phenyl-1,3-thiazol-2-yl)methyl]amino]propanamide Traditional Name: N-(1,3-benzodioxol-5-yl)-2-methyl-2-[(2-phenylacetyl)-[(4-phenylthiazol-2-yl)methyl]amino]propionamide Formula: C29H27N3O4S MolecularWeight: 513.60738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C(=O)NC1=CC2=C(C=C1)OCO2)N(CC3=NC(=CS3)C4=CC=CC=C4)C(=O)CC5=CC=CC=C5

Isomeric SMILES

CC(C)(C(=O)NC1=CC2=C(C=C1)OCO2)N(CC3=NC(=CS3)C4=CC=CC=C4)C(=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H27N3O4S/c1-29(2,28(34)30-22-13-14-24-25(16-22)36-19-35-24)32(27(33)15-20-9-5-3-6-10-20)17-26-31-23(18-37-26)21-11-7-4-8-12-21/h3-14,16,18H,15,17,19H2,1-2H3,(H,30,34)