N-[3-(azepan-1-yl)propyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)propyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide Openeye Name: N-[3-(azepan-1-yl)propyl]-4-benzyl-2,3-dihydro-1,4-benzothiazine-6-carboxamide CAS Name: N-[3-(1-azepanyl)propyl]-4-(phenylmethyl)-2,3-dihydro-1,4-benzothiazine-6-carboxamide IUPAC Name: N-[3-(azepan-1-yl)propyl]-4-benzyl-2,3-dihydro-1,4-benzothiazine-6-carboxamide Traditional Name: N-[3-(azepan-1-yl)propyl]-4-benzyl-2,3-dihydro-1,4-benzothiazine-6-carboxamide Formula: C25H33N3OS MolecularWeight: 423.61402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)SCCN3CC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CCCNC(=O)C2=CC3=C(C=C2)SCCN3CC4=CC=CC=C4

InChI

InChI=1S/C25H33N3OS/c29-25(26-13-8-16-27-14-6-1-2-7-15-27)22-11-12-24-23(19-22)28(17-18-30-24)20-21-9-4-3-5-10-21/h3-5,9-12,19H,1-2,6-8,13-18,20H2,(H,26,29)