1-(3-methylbutyl)-3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-(3-methylbutyl)-3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiourea Openeye Name: 1-isopentyl-3-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]thiourea CAS Name: 1-(3-methylbutyl)-3-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]thiourea IUPAC Name: 1-(3-methylbutyl)-3-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]thiourea Traditional Name: 1-isoamyl-3-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]thiourea Formula: C16H26N4O3S3 MolecularWeight: 418.59764

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=S)NNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

Isomeric SMILES

CC(C)CCNC(=S)NNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CS2

InChI

InChI=1S/C16H26N4O3S3/c1-12(2)5-8-17-16(24)19-18-15(21)13-6-9-20(10-7-13)26(22,23)14-4-3-11-25-14/h3-4,11-13H,5-10H2,1-2H3,(H,18,21)(H2,17,19,24)