2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-propan-2-yl-amino]ethanamide

Systemtic Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)amino]-2-oxidanylidene-ethyl]-propan-2-yl-amino]ethanamide Openeye Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(2-thienylmethyl)amino]-2-oxo-ethyl]-isopropyl-amino]acetamide CAS Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide IUPAC Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-propan-2-ylamino]acetamide Traditional Name: 2-[[2-[2,3-dihydro-1,4-benzodioxin-6-yl(2-thenyl)amino]-2-keto-ethyl]-isopropyl-amino]acetamide Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(CC(=O)N)CC(=O)N(CC1=CC=CS1)C2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC(C)N(CC(=O)N)CC(=O)N(CC1=CC=CS1)C2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C20H25N3O4S/c1-14(2)22(12-19(21)24)13-20(25)23(11-16-4-3-9-28-16)15-5-6-17-18(10-15)27-8-7-26-17/h3-6,9-10,14H,7-8,11-13H2,1-2H3,(H2,21,24)