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

Systemtic Name: 1-[(2S)-2-methylheptyl]-3-[(2-thiophen-3-yl-1,3-thiazol-4-yl)carbonylamino]thiourea Openeye Name: 1-[(2S)-2-methylheptyl]-3-[[2-(3-thienyl)thiazole-4-carbonyl]amino]thiourea CAS Name: 1-[(2S)-2-methylheptyl]-3-[[oxo-[2-(3-thiophenyl)-4-thiazolyl]methyl]amino]thiourea IUPAC Name: 1-[(2S)-2-methylheptyl]-3-[(2-thiophen-3-yl-1,3-thiazole-4-carbonyl)amino]thiourea Traditional Name: 1-[(2S)-2-methylheptyl]-3-[[2-(3-thienyl)thiazole-4-carbonyl]amino]thiourea Formula: C17H24N4OS3 MolecularWeight: 396.59366

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)CNC(=S)NNC(=O)C1=CSC(=N1)C2=CSC=C2

Isomeric SMILES

CCCCC[C@H](C)CNC(=S)NNC(=O)C1=CSC(=N1)C2=CSC=C2

InChI

InChI=1S/C17H24N4OS3/c1-3-4-5-6-12(2)9-18-17(23)21-20-15(22)14-11-25-16(19-14)13-7-8-24-10-13/h7-8,10-12H,3-6,9H2,1-2H3,(H,20,22)(H2,18,21,23)/t12-/m0/s1