1-(1,3-benzothiazol-2-yl)-3-[(2S)-pentan-2-yl]thiourea

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-3-[(2S)-pentan-2-yl]thiourea Openeye Name: 1-(1,3-benzothiazol-2-yl)-3-[(1S)-1-methylbutyl]thiourea CAS Name: 1-(1,3-benzothiazol-2-yl)-3-[(2S)-pentan-2-yl]thiourea IUPAC Name: 1-(1,3-benzothiazol-2-yl)-3-[(2S)-pentan-2-yl]thiourea Traditional Name: 1-(1,3-benzothiazol-2-yl)-3-[(1S)-1-methylbutyl]thiourea Formula: C13H17N3S2 MolecularWeight: 279.42418

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C)NC(=S)NC1=NC2=CC=CC=C2S1

Isomeric SMILES

CCC[C@H](C)NC(=S)NC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H17N3S2/c1-3-6-9(2)14-12(17)16-13-15-10-7-4-5-8-11(10)18-13/h4-5,7-9H,3,6H2,1-2H3,(H2,14,15,16,17)/t9-/m0/s1