N-(furan-2-ylmethyl)-4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-1,4-diazepane-1-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-4-imidazo[2,1-b][1,3]benzothiazol-2-ylcarbonyl-1,4-diazepane-1-carboxamide Openeye Name: N-(2-furylmethyl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide CAS Name: N-(2-furanylmethyl)-4-[2-imidazo[2,1-b][1,3]benzothiazolyl(oxo)methyl]-1,4-diazepane-1-carboxamide IUPAC Name: N-(furan-2-ylmethyl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(2-furfuryl)-4-(imidazo[2,1-b][1,3]benzothiazole-2-carbonyl)-1,4-diazepane-1-carboxamide Formula: C21H21N5O3S MolecularWeight: 423.48814

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)NCC2=CC=CO2)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

Isomeric SMILES

C1CN(CCN(C1)C(=O)NCC2=CC=CO2)C(=O)C3=CN4C5=CC=CC=C5SC4=N3

InChI

InChI=1S/C21H21N5O3S/c27-19(16-14-26-17-6-1-2-7-18(17)30-21(26)23-16)24-8-4-9-25(11-10-24)20(28)22-13-15-5-3-12-29-15/h1-3,5-7,12,14H,4,8-11,13H2,(H,22,28)