1-[4-[[1,4-bis(oxidanylidene)-3-pyrrolidin-1-yl-naphthalen-2-yl]amino]phenyl]-3-methyl-thiourea

Systemtic Name: 1-[4-[[1,4-bis(oxidanylidene)-3-pyrrolidin-1-yl-naphthalen-2-yl]amino]phenyl]-3-methyl-thiourea Openeye Name: 1-[4-[(1,4-dioxo-3-pyrrolidin-1-yl-2-naphthyl)amino]phenyl]-3-methyl-thiourea CAS Name: 1-[4-[[1,4-dioxo-3-(1-pyrrolidinyl)-2-naphthalenyl]amino]phenyl]-3-methylthiourea IUPAC Name: 1-[4-[(1,4-dioxo-3-pyrrolidin-1-ylnaphthalen-2-yl)amino]phenyl]-3-methylthiourea Traditional Name: 1-[4-[(1,4-diketo-3-pyrrolidino-2-naphthyl)amino]phenyl]-3-methyl-thiourea Formula: C22H22N4O2S MolecularWeight: 406.50068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCC4

Isomeric SMILES

CNC(=S)NC1=CC=C(C=C1)NC2=C(C(=O)C3=CC=CC=C3C2=O)N4CCCC4

InChI

InChI=1S/C22H22N4O2S/c1-23-22(29)25-15-10-8-14(9-11-15)24-18-19(26-12-4-5-13-26)21(28)17-7-3-2-6-16(17)20(18)27/h2-3,6-11,24H,4-5,12-13H2,1H3,(H2,23,25,29)