N-[3-(phenylmethyl)sulfonyl-2-(pyrazin-2-ylcarbonylamino)propanoyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide

Systemtic Name: N-[3-(phenylmethyl)sulfonyl-2-(pyrazin-2-ylcarbonylamino)propanoyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide Openeye Name: N-[3-benzylsulfonyl-2-(pyrazine-2-carbonylamino)propanoyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide CAS Name: N-[1-oxo-2-[[oxo(2-pyrazinyl)methyl]amino]-3-(phenylmethyl)sulfonylpropyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide IUPAC Name: N-[3-benzylsulfonyl-2-(pyrazine-2-carbonylamino)propanoyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide Traditional Name: N-[3-benzylsulfonyl-2-(pyrazinoylamino)propanoyl]-N-(3-phenylpropyl)-1,3-benzoxazole-2-carboxamide Formula: C32H29N5O6S MolecularWeight: 611.66756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCN(C(=O)C2=NC3=CC=CC=C3O2)C(=O)C(CS(=O)(=O)CC4=CC=CC=C4)NC(=O)C5=NC=CN=C5

Isomeric SMILES

C1=CC=C(C=C1)CCCN(C(=O)C2=NC3=CC=CC=C3O2)C(=O)C(CS(=O)(=O)CC4=CC=CC=C4)NC(=O)C5=NC=CN=C5

InChI

InChI=1S/C32H29N5O6S/c38-29(26-20-33-17-18-34-26)35-27(22-44(41,42)21-24-12-5-2-6-13-24)31(39)37(19-9-14-23-10-3-1-4-11-23)32(40)30-36-25-15-7-8-16-28(25)43-30/h1-8,10-13,15-18,20,27H,9,14,19,21-22H2,(H,35,38)