1-(4-morpholin-4-ylsulfonylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]thiourea

Systemtic Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]thiourea Openeye Name: 1-(4-morpholinosulfonylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]thiourea CAS Name: 1-[4-(4-morpholinylsulfonyl)phenyl]-3-[[1-oxo-3-(4-phenyl-1-piperazinyl)propyl]amino]thiourea IUPAC Name: 1-(4-morpholin-4-ylsulfonylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propanoylamino]thiourea Traditional Name: 1-(4-morpholinosulfonylphenyl)-3-[3-(4-phenylpiperazino)propanoylamino]thiourea Formula: C24H32N6O4S2 MolecularWeight: 532.67868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCC(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCC(=O)NNC(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)C4=CC=CC=C4

InChI

InChI=1S/C24H32N6O4S2/c31-23(10-11-28-12-14-29(15-13-28)21-4-2-1-3-5-21)26-27-24(35)25-20-6-8-22(9-7-20)36(32,33)30-16-18-34-19-17-30/h1-9H,10-19H2,(H,26,31)(H2,25,27,35)