N-[4-(azepan-1-yl)phenyl]-1,3-benzothiazole-6-carboxamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-1,3-benzothiazole-6-carboxamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-1,3-benzothiazole-6-carboxamide CAS Name: N-[4-(1-azepanyl)phenyl]-1,3-benzothiazole-6-carboxamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-1,3-benzothiazole-6-carboxamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-1,3-benzothiazole-6-carboxamide Formula: C20H21N3OS MolecularWeight: 351.46524

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=CS4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)C3=CC4=C(C=C3)N=CS4

InChI

InChI=1S/C20H21N3OS/c24-20(15-5-10-18-19(13-15)25-14-21-18)22-16-6-8-17(9-7-16)23-11-3-1-2-4-12-23/h5-10,13-14H,1-4,11-12H2,(H,22,24)