5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one

Systemtic Name: 5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one Openeye Name: 5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one CAS Name: 5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one IUPAC Name: 5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one Traditional Name: 5-cyclohexyl-2,2-dimethyl-3-(methylamino)-3H-1,5-benzothiazepin-4-one Formula: C18H26N2OS MolecularWeight: 318.47684

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(=O)N(C2=CC=CC=C2S1)C3CCCCC3)NC)C

Isomeric SMILES

CC1(C(C(=O)N(C2=CC=CC=C2S1)C3CCCCC3)NC)C

InChI

InChI=1S/C18H26N2OS/c1-18(2)16(19-3)17(21)20(13-9-5-4-6-10-13)14-11-7-8-12-15(14)22-18/h7-8,11-13,16,19H,4-6,9-10H2,1-3H3