N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[1-(furan-2-yl)ethylamino]ethanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[1-(furan-2-yl)ethylamino]ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[1-(2-furyl)ethylamino]acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-2-[1-(2-furanyl)ethylamino]acetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-2-[1-(furan-2-yl)ethylamino]acetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-2-[1-(2-furyl)ethylamino]acetamide Formula: C21H29N3O5S MolecularWeight: 435.53706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CO1)NCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CC(C1=CC=CO1)NCC(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C21H29N3O5S/c1-16(19-8-7-13-29-19)22-15-21(25)23-18-14-17(9-10-20(18)28-2)30(26,27)24-11-5-3-4-6-12-24/h7-10,13-14,16,22H,3-6,11-12,15H2,1-2H3,(H,23,25)