N-[(5S)-5-(azepan-1-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide

Systemtic Name: N-[(5S)-5-(azepan-1-ylcarbonyl)-7-oxidanylidene-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide Openeye Name: N-[(5S)-5-(azepane-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide CAS Name: N-[(5S)-5-[1-azepanyl(oxo)methyl]-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide IUPAC Name: N-[(5S)-5-(azepane-1-carbonyl)-7-oxo-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide Traditional Name: N-[(5S)-5-(azepane-1-carbonyl)-7-keto-5,6-dihydro-4H-1,3-benzothiazol-2-yl]cyclobutanecarboxamide Formula: C19H25N3O3S MolecularWeight: 375.4851

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CC3=C(C(=O)C2)SC(=N3)NC(=O)C4CCC4

Isomeric SMILES

C1CCCN(CC1)C(=O)[C@H]2CC3=C(C(=O)C2)SC(=N3)NC(=O)C4CCC4

InChI

InChI=1S/C19H25N3O3S/c23-15-11-13(18(25)22-8-3-1-2-4-9-22)10-14-16(15)26-19(20-14)21-17(24)12-6-5-7-12/h12-13H,1-11H2,(H,20,21,24)/t13-/m0/s1