1-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea

Systemtic Name: 1-[3-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea Openeye Name: 1-[3-(1,3-dioxoisoindolin-2-yl)propanoylamino]-3-(3-methoxypropyl)-1-methyl-thiourea CAS Name: 1-[[3-(1,3-dioxo-2-isoindolyl)-1-oxopropyl]amino]-3-(3-methoxypropyl)-1-methylthiourea IUPAC Name: 1-[3-(1,3-dioxoisoindol-2-yl)propanoylamino]-3-(3-methoxypropyl)-1-methylthiourea Traditional Name: 3-(3-methoxypropyl)-1-methyl-1-(3-phthalimidopropanoylamino)thiourea Formula: C17H22N4O4S MolecularWeight: 378.44598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=S)NCCCOC)NC(=O)CCN1C(=O)C2=CC=CC=C2C1=O

Isomeric SMILES

CN(C(=S)NCCCOC)NC(=O)CCN1C(=O)C2=CC=CC=C2C1=O

InChI

InChI=1S/C17H22N4O4S/c1-20(17(26)18-9-5-11-25-2)19-14(22)8-10-21-15(23)12-6-3-4-7-13(12)16(21)24/h3-4,6-7H,5,8-11H2,1-2H3,(H,18,26)(H,19,22)