N-[(3S)-2-oxidanylideneazepan-3-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide

Systemtic Name: N-[(3S)-2-oxidanylideneazepan-3-yl]-3-(3-oxidanylidene-1,4-benzothiazin-4-yl)propanamide Openeye Name: N-[(3S)-2-oxoazepan-3-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide CAS Name: N-[(3S)-2-oxo-3-azepanyl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide IUPAC Name: N-[(3S)-2-oxoazepan-3-yl]-3-(3-oxo-1,4-benzothiazin-4-yl)propanamide Traditional Name: N-[(3S)-2-ketoazepan-3-yl]-3-(3-keto-1,4-benzothiazin-4-yl)propionamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC(=O)CCN2C(=O)CSC3=CC=CC=C32

InChI

InChI=1S/C17H21N3O3S/c21-15(19-12-5-3-4-9-18-17(12)23)8-10-20-13-6-1-2-7-14(13)24-11-16(20)22/h1-2,6-7,12H,3-5,8-11H2,(H,18,23)(H,19,21)/t12-/m0/s1