1-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-3-(2-thiophen-2-ylethyl)thiourea

Systemtic Name: 1-[2-[methyl-(4-methylphenyl)sulfonyl-amino]ethanoylamino]-3-(2-thiophen-2-ylethyl)thiourea Openeye Name: 1-[[2-[methyl(p-tolylsulfonyl)amino]acetyl]amino]-3-[2-(2-thienyl)ethyl]thiourea CAS Name: 1-[[2-[methyl-(4-methylphenyl)sulfonylamino]-1-oxoethyl]amino]-3-(2-thiophen-2-ylethyl)thiourea IUPAC Name: 1-[[2-[methyl-(4-methylphenyl)sulfonylamino]acetyl]amino]-3-(2-thiophen-2-ylethyl)thiourea Traditional Name: 1-[[2-[methyl(tosyl)amino]acetyl]amino]-3-[2-(2-thienyl)ethyl]thiourea Formula: C17H22N4O3S3 MolecularWeight: 426.57658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NNC(=S)NCCC2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N(C)CC(=O)NNC(=S)NCCC2=CC=CS2

InChI

InChI=1S/C17H22N4O3S3/c1-13-5-7-15(8-6-13)27(23,24)21(2)12-16(22)19-20-17(25)18-10-9-14-4-3-11-26-14/h3-8,11H,9-10,12H2,1-2H3,(H,19,22)(H2,18,20,25)