N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-2-(2,2-diphenylethanoylamino)propanamide

Systemtic Name: N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-2-(2,2-diphenylethanoylamino)propanamide Openeye Name: N-[4-(1-adamantylmethyl)thiazol-2-yl]-2-[(2,2-diphenylacetyl)amino]propanamide CAS Name: N-[4-(1-adamantylmethyl)-2-thiazolyl]-2-[(1-oxo-2,2-diphenylethyl)amino]propanamide IUPAC Name: N-[4-(1-adamantylmethyl)-1,3-thiazol-2-yl]-2-[(2,2-diphenylacetyl)amino]propanamide Traditional Name: N-[4-(1-adamantylmethyl)thiazol-2-yl]-2-[(2,2-diphenylacetyl)amino]propionamide Formula: C31H35N3O2S MolecularWeight: 513.6935

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NC(=CS1)CC23CC4CC(C2)CC(C4)C3)NC(=O)C(C5=CC=CC=C5)C6=CC=CC=C6

Isomeric SMILES

CC(C(=O)NC1=NC(=CS1)CC23CC4CC(C2)CC(C4)C3)NC(=O)C(C5=CC=CC=C5)C6=CC=CC=C6

InChI

InChI=1S/C31H35N3O2S/c1-20(32-29(36)27(24-8-4-2-5-9-24)25-10-6-3-7-11-25)28(35)34-30-33-26(19-37-30)18-31-15-21-12-22(16-31)14-23(13-21)17-31/h2-11,19-23,27H,12-18H2,1H3,(H,32,36)(H,33,34,35)