2-[4-(5,6-diphenylpyrazin-2-yl)butoxy]-N-(phenylsulfonyl)ethanamide; propan-2-amine

Systemtic Name: 2-[4-(5,6-diphenylpyrazin-2-yl)butoxy]-N-(phenylsulfonyl)ethanamide; propan-2-amine Openeye Name: N-(benzenesulfonyl)-2-[4-(5,6-diphenylpyrazin-2-yl)butoxy]acetamide; propan-2-amine CAS Name: N-(benzenesulfonyl)-2-[4-(5,6-diphenyl-2-pyrazinyl)butoxy]acetamide; 2-propanamine IUPAC Name: N-(benzenesulfonyl)-2-[4-(5,6-diphenylpyrazin-2-yl)butoxy]acetamide; propan-2-amine Traditional Name: N-besyl-2-[4-(5,6-diphenylpyrazin-2-yl)butoxy]acetamide; isopropylamine Formula: C31H36N4O4S MolecularWeight: 560.70694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N.C1=CC=C(C=C1)C2=NC=C(N=C2C3=CC=CC=C3)CCCCOCC(=O)NS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

CC(C)N.C1=CC=C(C=C1)C2=NC=C(N=C2C3=CC=CC=C3)CCCCOCC(=O)NS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C28H27N3O4S.C3H9N/c32-26(31-36(33,34)25-17-8-3-9-18-25)21-35-19-11-10-16-24-20-29-27(22-12-4-1-5-13-22)28(30-24)23-14-6-2-7-15-23;1-3(2)4/h1-9,12-15,17-18,20H,10-11,16,19,21H2,(H,31,32);3H,4H2,1-2H3