N-[4-(azepan-1-ylcarbonyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide Openeye Name: N-[4-(azepane-1-carbonyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide IUPAC Name: N-[4-(azepane-1-carbonyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide Traditional Name: N-[4-(azepane-1-carbonyl)-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCCC3=C2N=C(S3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C21H25N3O2S/c25-19(15-9-4-3-5-10-15)23-21-22-18-16(11-8-12-17(18)27-21)20(26)24-13-6-1-2-7-14-24/h3-5,9-10,16H,1-2,6-8,11-14H2,(H,22,23,25)