3-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one

Systemtic Name: 3-[3-azanyl-4-(4-methylpiperazin-1-yl)phenyl]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one Openeye Name: 3-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]-1-[(3S)-3-methyl-1-piperidyl]propan-1-one CAS Name: 3-[3-amino-4-(4-methyl-1-piperazinyl)phenyl]-1-[(3S)-3-methyl-1-piperidinyl]-1-propanone IUPAC Name: 3-[3-amino-4-(4-methylpiperazin-1-yl)phenyl]-1-[(3S)-3-methylpiperidin-1-yl]propan-1-one Traditional Name: 3-[3-amino-4-(4-methylpiperazino)phenyl]-1-[(3S)-3-methylpiperidino]propan-1-one Formula: C20H32N4O MolecularWeight: 344.49428

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C(=O)CCC2=CC(=C(C=C2)N3CCN(CC3)C)N

Isomeric SMILES

C[C@H]1CCCN(C1)C(=O)CCC2=CC(=C(C=C2)N3CCN(CC3)C)N

InChI

InChI=1S/C20H32N4O/c1-16-4-3-9-24(15-16)20(25)8-6-17-5-7-19(18(21)14-17)23-12-10-22(2)11-13-23/h5,7,14,16H,3-4,6,8-13,15,21H2,1-2H3/t16-/m0/s1