1-[3-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methylamino]propyl]azepan-2-one

Systemtic Name: 1-[3-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methylamino]propyl]azepan-2-one Openeye Name: 1-[3-[[4-[(2-methylthiazol-4-yl)methoxy]phenyl]methylamino]propyl]azepan-2-one CAS Name: 1-[3-[[4-[(2-methyl-4-thiazolyl)methoxy]phenyl]methylamino]propyl]-2-azepanone IUPAC Name: 1-[3-[[4-[(2-methyl-1,3-thiazol-4-yl)methoxy]phenyl]methylamino]propyl]azepan-2-one Traditional Name: 1-[3-[[4-[(2-methylthiazol-4-yl)methoxy]benzyl]amino]propyl]azepan-2-one Formula: C21H29N3O2S MolecularWeight: 387.53886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CS1)COC2=CC=C(C=C2)CNCCCN3CCCCCC3=O

Isomeric SMILES

CC1=NC(=CS1)COC2=CC=C(C=C2)CNCCCN3CCCCCC3=O

InChI

InChI=1S/C21H29N3O2S/c1-17-23-19(16-27-17)15-26-20-9-7-18(8-10-20)14-22-11-5-13-24-12-4-2-3-6-21(24)25/h7-10,16,22H,2-6,11-15H2,1H3