1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-(4-fluorophenyl)thiourea

Systemtic Name: 1-[2-(1,3-benzothiazol-2-ylamino)ethanoylamino]-3-(4-fluorophenyl)thiourea Openeye Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-(4-fluorophenyl)thiourea CAS Name: 1-[[2-(1,3-benzothiazol-2-ylamino)-1-oxoethyl]amino]-3-(4-fluorophenyl)thiourea IUPAC Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-(4-fluorophenyl)thiourea Traditional Name: 1-[[2-(1,3-benzothiazol-2-ylamino)acetyl]amino]-3-(4-fluorophenyl)thiourea Formula: C16H14FN5OS2 MolecularWeight: 375.443663

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)NCC(=O)NNC(=S)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)NCC(=O)NNC(=S)NC3=CC=C(C=C3)F

InChI

InChI=1S/C16H14FN5OS2/c17-10-5-7-11(8-6-10)19-15(24)22-21-14(23)9-18-16-20-12-3-1-2-4-13(12)25-16/h1-8H,9H2,(H,18,20)(H,21,23)(H2,19,22,24)