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

Systemtic Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-propan-2-yl-thiourea Openeye Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-isopropyl-thiourea CAS Name: 1-[[3-(1,3-benzothiazol-2-yl)-1-oxopropyl]amino]-3-propan-2-ylthiourea IUPAC Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-propan-2-ylthiourea Traditional Name: 1-[3-(1,3-benzothiazol-2-yl)propanoylamino]-3-isopropyl-thiourea Formula: C14H18N4OS2 MolecularWeight: 322.44892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NNC(=O)CCC1=NC2=CC=CC=C2S1

Isomeric SMILES

CC(C)NC(=S)NNC(=O)CCC1=NC2=CC=CC=C2S1

InChI

InChI=1S/C14H18N4OS2/c1-9(2)15-14(20)18-17-12(19)7-8-13-16-10-5-3-4-6-11(10)21-13/h3-6,9H,7-8H2,1-2H3,(H,17,19)(H2,15,18,20)