(2S)-2-[methyl-(1-methylpiperidin-4-yl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone

Systemtic Name: (2S)-2-[methyl-(1-methylpiperidin-4-yl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone Openeye Name: (2S)-2-[methyl-(1-methyl-4-piperidyl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone CAS Name: (2S)-2-[methyl-(1-methyl-4-piperidinyl)amino]-1-(1-piperazinyl)-2-(1H-pyrrol-2-yl)ethanone IUPAC Name: (2S)-2-[methyl-(1-methylpiperidin-4-yl)amino]-1-piperazin-1-yl-2-(1H-pyrrol-2-yl)ethanone Traditional Name: (2S)-2-[methyl-(1-methyl-4-piperidyl)amino]-1-piperazino-2-(1H-pyrrol-2-yl)ethanone Formula: C17H29N5O MolecularWeight: 319.44506

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C(C2=CC=CN2)C(=O)N3CCNCC3

Isomeric SMILES

CN1CCC(CC1)N(C)[C@@H](C2=CC=CN2)C(=O)N3CCNCC3

InChI

InChI=1S/C17H29N5O/c1-20-10-5-14(6-11-20)21(2)16(15-4-3-7-19-15)17(23)22-12-8-18-9-13-22/h3-4,7,14,16,18-19H,5-6,8-13H2,1-2H3/t16-/m0/s1