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

Systemtic Name: 1-(2-methylphenyl)-3-[(1-thiophen-2-ylsulfonylpiperidin-4-yl)carbonylamino]thiourea Openeye Name: 1-(o-tolyl)-3-[[1-(2-thienylsulfonyl)piperidine-4-carbonyl]amino]thiourea CAS Name: 1-(2-methylphenyl)-3-[[oxo-(1-thiophen-2-ylsulfonyl-4-piperidinyl)methyl]amino]thiourea IUPAC Name: 1-(2-methylphenyl)-3-[(1-thiophen-2-ylsulfonylpiperidine-4-carbonyl)amino]thiourea Traditional Name: 1-(o-tolyl)-3-[[1-(2-thienylsulfonyl)isonipecotoyl]amino]thiourea Formula: C18H22N4O3S3 MolecularWeight: 438.58728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CC1=CC=CC=C1NC(=S)NNC(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C18H22N4O3S3/c1-13-5-2-3-6-15(13)19-18(26)21-20-17(23)14-8-10-22(11-9-14)28(24,25)16-7-4-12-27-16/h2-7,12,14H,8-11H2,1H3,(H,20,23)(H2,19,21,26)