11-[2-[butyl(pentyl)amino]ethyl]-6H-benzo[c][1]benzothiepine-11-carboxamide

Systemtic Name: 11-[2-[butyl(pentyl)amino]ethyl]-6H-benzo[c][1]benzothiepine-11-carboxamide Openeye Name: 11-[2-[butyl(pentyl)amino]ethyl]-6H-benzo[c][1]benzothiepine-11-carboxamide CAS Name: 11-[2-[butyl(pentyl)amino]ethyl]-6H-benzo[c][1]benzothiepin-11-carboxamide IUPAC Name: 11-[2-[butyl(pentyl)amino]ethyl]-6H-benzo[c][1]benzothiepine-11-carboxamide Traditional Name: 11-[2-[amyl(butyl)amino]ethyl]-6H-benzo[c][1]benzothiepin-11-carboxamide Formula: C26H36N2OS MolecularWeight: 424.64184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCC)CCC1(C2=CC=CC=C2CSC3=CC=CC=C31)C(=O)N

Isomeric SMILES

CCCCCN(CCCC)CCC1(C2=CC=CC=C2CSC3=CC=CC=C31)C(=O)N

InChI

InChI=1S/C26H36N2OS/c1-3-5-11-18-28(17-6-4-2)19-16-26(25(27)29)22-13-8-7-12-21(22)20-30-24-15-10-9-14-23(24)26/h7-10,12-15H,3-6,11,16-20H2,1-2H3,(H2,27,29)