[2-(phenylcarbamoylamino)-1,3-benzothiazol-6-yl] butanoate

Systemtic Name: [2-(phenylcarbamoylamino)-1,3-benzothiazol-6-yl] butanoate Openeye Name: [2-(phenylcarbamoylamino)-1,3-benzothiazol-6-yl] butanoate CAS Name: butanoic acid [2-[[anilino(oxo)methyl]amino]-1,3-benzothiazol-6-yl] ester IUPAC Name: [2-(phenylcarbamoylamino)-1,3-benzothiazol-6-yl] butanoate Traditional Name: butyric acid [2-(phenylcarbamoylamino)-1,3-benzothiazol-6-yl] ester Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)OC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCC(=O)OC1=CC2=C(C=C1)N=C(S2)NC(=O)NC3=CC=CC=C3

InChI

InChI=1S/C18H17N3O3S/c1-2-6-16(22)24-13-9-10-14-15(11-13)25-18(20-14)21-17(23)19-12-7-4-3-5-8-12/h3-5,7-11H,2,6H2,1H3,(H2,19,20,21,23)