1-[(2S)-2-methylheptyl]-3-[(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylamino]thiourea

Systemtic Name: 1-[(2S)-2-methylheptyl]-3-[(1-thiophen-2-ylcarbonylpiperidin-4-yl)carbonylamino]thiourea Openeye Name: 1-[(2S)-2-methylheptyl]-3-[[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]amino]thiourea CAS Name: 1-[(2S)-2-methylheptyl]-3-[[oxo-[1-[oxo(thiophen-2-yl)methyl]-4-piperidinyl]methyl]amino]thiourea IUPAC Name: 1-[(2S)-2-methylheptyl]-3-[[1-(thiophene-2-carbonyl)piperidine-4-carbonyl]amino]thiourea Traditional Name: 1-[(2S)-2-methylheptyl]-3-[[1-(2-thenoyl)isonipecotoyl]amino]thiourea Formula: C20H32N4O2S2 MolecularWeight: 424.62368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)C1CCN(CC1)C(=O)C2=CC=CS2

InChI

InChI=1S/C20H32N4O2S2/c1-3-4-5-7-15(2)14-21-20(27)23-22-18(25)16-9-11-24(12-10-16)19(26)17-8-6-13-28-17/h6,8,13,15-16H,3-5,7,9-12,14H2,1-2H3,(H,22,25)(H2,21,23,27)/t15-/m0/s1