tert-butyl N-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-(furan-2-yl)-1-oxidanylidene-propan-2-yl]carbamate

Systemtic Name: tert-butyl N-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-(furan-2-yl)-1-oxidanylidene-propan-2-yl]carbamate Openeye Name: tert-butyl N-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-(2-furylmethyl)-2-oxo-ethyl]carbamate CAS Name: N-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-(2-furanyl)-1-oxopropan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[1-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-3-(furan-2-yl)-1-oxopropan-2-yl]carbamate Traditional Name: N-[2-[(6-ethoxy-1,3-benzothiazol-2-yl)amino]-1-(2-furfuryl)-2-keto-ethyl]carbamic acid tert-butyl ester Formula: C21H25N3O5S MolecularWeight: 431.5053

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CC3=CC=CO3)NC(=O)OC(C)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(S2)NC(=O)C(CC3=CC=CO3)NC(=O)OC(C)(C)C

InChI

InChI=1S/C21H25N3O5S/c1-5-27-14-8-9-15-17(12-14)30-19(22-15)24-18(25)16(11-13-7-6-10-28-13)23-20(26)29-21(2,3)4/h6-10,12,16H,5,11H2,1-4H3,(H,23,26)(H,22,24,25)