1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-methyl-thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-methyl-thiourea Openeye Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-methyl-thiourea CAS Name: 1-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]amino]-3-methylthiourea IUPAC Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-methylthiourea Traditional Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-methyl-thiourea Formula: C11H13N5OS2 MolecularWeight: 295.38382

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NNC(=O)CNC1=NC2=CC=CC=C2S1

Isomeric SMILES

CNC(=S)NNC(=O)CNC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C11H13N5OS2/c1-12-10(18)16-15-9(17)6-13-11-14-7-4-2-3-5-8(7)19-11/h2-5H,6H2,1H3,(H,13,14)(H,15,17)(H2,12,16,18)