[2-(4-methylpiperazin-1-yl)-4-(phenethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-piperidin-1-yl-methanone

Systemtic Name: [2-(4-methylpiperazin-1-yl)-4-(phenethylamino)-5-piperidin-1-ylsulfonyl-phenyl]-piperidin-1-yl-methanone Openeye Name: [2-(4-methylpiperazin-1-yl)-4-(phenethylamino)-5-(1-piperidylsulfonyl)phenyl]-(1-piperidyl)methanone CAS Name: [2-(4-methyl-1-piperazinyl)-4-(phenethylamino)-5-(1-piperidinylsulfonyl)phenyl]-(1-piperidinyl)methanone IUPAC Name: [2-(4-methylpiperazin-1-yl)-4-(phenethylamino)-5-piperidin-1-ylsulfonylphenyl]-piperidin-1-ylmethanone Traditional Name: [2-(4-methylpiperazino)-4-(phenethylamino)-5-piperidinosulfonyl-phenyl]-piperidino-methanone Formula: C30H43N5O3S MolecularWeight: 553.75912

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC(=C(C=C2C(=O)N3CCCCC3)S(=O)(=O)N4CCCCC4)NCCC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)C2=CC(=C(C=C2C(=O)N3CCCCC3)S(=O)(=O)N4CCCCC4)NCCC5=CC=CC=C5

InChI

InChI=1S/C30H43N5O3S/c1-32-19-21-33(22-20-32)28-24-27(31-14-13-25-11-5-2-6-12-25)29(39(37,38)35-17-9-4-10-18-35)23-26(28)30(36)34-15-7-3-8-16-34/h2,5-6,11-12,23-24,31H,3-4,7-10,13-22H2,1H3