5-methyl-3-[3-[3-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1,2-oxazole

Systemtic Name: 5-methyl-3-[3-[3-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1,2-oxazole Openeye Name: 3-[3-[3-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-5-methyl-isoxazole CAS Name: 5-methyl-3-[3-[3-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)thio]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]isoxazole IUPAC Name: 5-methyl-3-[3-[3-[(4-methyl-5-propan-2-yl-1,2,4-triazol-3-yl)sulfanyl]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-1,2-oxazole Traditional Name: 3-[3-[3-[(5-isopropyl-4-methyl-1,2,4-triazol-3-yl)thio]propyl]-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-5-methyl-isoxazole Formula: C23H31N5OS MolecularWeight: 425.59014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)C2=CC3=C(CCN(CC3)CCCSC4=NN=C(N4C)C(C)C)C=C2

Isomeric SMILES

CC1=CC(=NO1)C2=CC3=C(CCN(CC3)CCCSC4=NN=C(N4C)C(C)C)C=C2

InChI

InChI=1S/C23H31N5OS/c1-16(2)22-24-25-23(27(22)4)30-13-5-10-28-11-8-18-6-7-20(15-19(18)9-12-28)21-14-17(3)29-26-21/h6-7,14-16H,5,8-13H2,1-4H3