7-bromanyl-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one

Systemtic Name: 7-bromanyl-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one Openeye Name: 7-bromo-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one CAS Name: 7-bromo-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one IUPAC Name: 7-bromo-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one Traditional Name: 7-bromo-3-butyl-3-ethyl-5-phenyl-2H-1,5-benzothiazepin-4-one Formula: C21H24BrNOS MolecularWeight: 418.39036

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(CSC2=C(C=C(C=C2)Br)N(C1=O)C3=CC=CC=C3)CC

Isomeric SMILES

CCCCC1(CSC2=C(C=C(C=C2)Br)N(C1=O)C3=CC=CC=C3)CC

InChI

InChI=1S/C21H24BrNOS/c1-3-5-13-21(4-2)15-25-19-12-11-16(22)14-18(19)23(20(21)24)17-9-7-6-8-10-17/h6-12,14H,3-5,13,15H2,1-2H3