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

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-isopropyl-thiourea CAS Name: 1-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-propan-2-ylthiourea Traditional Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-isopropyl-thiourea Formula: C13H17N5OS2 MolecularWeight: 323.43698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)CNC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)NC(=S)NNC(=O)CNC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C13H17N5OS2/c1-8(2)15-12(20)18-17-11(19)7-14-13-16-9-5-3-4-6-10(9)21-13/h3-6,8H,7H2,1-2H3,(H,14,16)(H,17,19)(H2,15,18,20)