3-(methylamino)-5-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-4-one

Systemtic Name: 3-(methylamino)-5-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-4-one Openeye Name: 5-isopropyl-3-(methylamino)-2,3-dihydro-1,5-benzothiazepin-4-one CAS Name: 3-(methylamino)-5-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-4-one IUPAC Name: 3-(methylamino)-5-propan-2-yl-2,3-dihydro-1,5-benzothiazepin-4-one Traditional Name: 5-isopropyl-3-(methylamino)-2,3-dihydro-1,5-benzothiazepin-4-one Formula: C13H18N2OS MolecularWeight: 250.35982

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=CC=CC=C2SCC(C1=O)NC

Isomeric SMILES

CC(C)N1C2=CC=CC=C2SCC(C1=O)NC

InChI

InChI=1S/C13H18N2OS/c1-9(2)15-11-6-4-5-7-12(11)17-8-10(14-3)13(15)16/h4-7,9-10,14H,8H2,1-3H3