1-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanoylamino]-3-propan-2-yl-thiourea

Systemtic Name: 1-[2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)propanoylamino]-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-[2-(1-methylene-3-oxo-isoindolin-2-yl)propanoylamino]thiourea CAS Name: 1-[[2-(1-methylene-3-oxo-2-isoindolyl)-1-oxopropyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[2-(1-methylidene-3-oxoisoindol-2-yl)propanoylamino]-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-[2-(1-keto-3-methylene-isoindolin-2-yl)propanoylamino]thiourea Formula: C16H20N4O2S MolecularWeight: 332.4206

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)C(C)N1C(=C)C2=CC=CC=C2C1=O

Isomeric SMILES

CC(C)NC(=S)NNC(=O)C(C)N1C(=C)C2=CC=CC=C2C1=O

InChI

InChI=1S/C16H20N4O2S/c1-9(2)17-16(23)19-18-14(21)11(4)20-10(3)12-7-5-6-8-13(12)15(20)22/h5-9,11H,3H2,1-2,4H3,(H,18,21)(H2,17,19,23)