1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(2-fluorophenyl)thiourea

Systemtic Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(2-fluorophenyl)thiourea Openeye Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(2-fluorophenyl)thiourea CAS Name: 1-[[5-(1,3-benzothiazol-2-yl)-1-oxopentyl]amino]-3-(2-fluorophenyl)thiourea IUPAC Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(2-fluorophenyl)thiourea Traditional Name: 1-[5-(1,3-benzothiazol-2-yl)pentanoylamino]-3-(2-fluorophenyl)thiourea Formula: C19H19FN4OS2 MolecularWeight: 402.508763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)CCCCC(=O)NNC(=S)NC3=CC=CC=C3F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)CCCCC(=O)NNC(=S)NC3=CC=CC=C3F

InChI

InChI=1S/C19H19FN4OS2/c20-13-7-1-2-8-14(13)22-19(26)24-23-17(25)11-5-6-12-18-21-15-9-3-4-10-16(15)27-18/h1-4,7-10H,5-6,11-12H2,(H,23,25)(H2,22,24,26)