3-methyl-7-(4-methylpiperazin-1-yl)sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one

Systemtic Name: 3-methyl-7-(4-methylpiperazin-1-yl)sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Openeye Name: 3-methyl-7-(4-methylpiperazin-1-yl)sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one CAS Name: 3-methyl-7-[(4-methyl-1-piperazinyl)sulfonyl]-3,5-dihydro-2H-1,5-benzothiazepin-4-one IUPAC Name: 3-methyl-7-(4-methylpiperazin-1-yl)sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Traditional Name: 3-methyl-7-(4-methylpiperazino)sulfonyl-3,5-dihydro-2H-1,5-benzothiazepin-4-one Formula: C15H21N3O3S2 MolecularWeight: 355.47554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)NC1=O

Isomeric SMILES

CC1CSC2=C(C=C(C=C2)S(=O)(=O)N3CCN(CC3)C)NC1=O

InChI

InChI=1S/C15H21N3O3S2/c1-11-10-22-14-4-3-12(9-13(14)16-15(11)19)23(20,21)18-7-5-17(2)6-8-18/h3-4,9,11H,5-8,10H2,1-2H3,(H,16,19)