ethyl 3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]piperidine-1-carboxylate

Systemtic Name: ethyl 3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]piperidine-1-carboxylate Openeye Name: ethyl 3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylcarbamoyl]piperidine-1-carboxylate CAS Name: 3-[[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylamino]-oxomethyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylcarbamoyl]piperidine-1-carboxylate Traditional Name: 3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylcarbamoyl]piperidine-1-carboxylic acid ethyl ester Formula: C21H23N3O4S MolecularWeight: 413.49002

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCCC(C1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC(=O)N1CCCC(C1)C(=O)NCC2=CC=C(O2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H23N3O4S/c1-2-27-21(26)24-11-5-6-14(13-24)19(25)22-12-15-9-10-17(28-15)20-23-16-7-3-4-8-18(16)29-20/h3-4,7-10,14H,2,5-6,11-13H2,1H3,(H,22,25)