tert-butyl N-[3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]-3-oxo-propyl]carbamate CAS Name: N-[3-[[5-(1,3-benzothiazol-2-yl)-2-furanyl]methylamino]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[[5-(1,3-benzothiazol-2-yl)furan-2-yl]methylamino]-3-oxopropyl]carbamate Traditional Name: N-[3-[[5-(1,3-benzothiazol-2-yl)-2-furyl]methylamino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C20H23N3O4S MolecularWeight: 401.47932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(O1)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)NCC1=CC=C(O1)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H23N3O4S/c1-20(2,3)27-19(25)21-11-10-17(24)22-12-13-8-9-15(26-13)18-23-14-6-4-5-7-16(14)28-18/h4-9H,10-12H2,1-3H3,(H,21,25)(H,22,24)