6-(azepan-1-ylsulfonyl)-2-oxidanylidene-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-quinoline-4-carboxamide

Systemtic Name: 6-(azepan-1-ylsulfonyl)-2-oxidanylidene-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-quinoline-4-carboxamide Openeye Name: 6-(azepan-1-ylsulfonyl)-2-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-quinoline-4-carboxamide CAS Name: 6-(1-azepanylsulfonyl)-2-oxo-N-[3-(4-propyl-1-piperazinyl)propyl]-1H-quinoline-4-carboxamide IUPAC Name: 6-(azepan-1-ylsulfonyl)-2-oxo-N-[3-(4-propylpiperazin-1-yl)propyl]-1H-quinoline-4-carboxamide Traditional Name: 6-(azepan-1-ylsulfonyl)-2-keto-N-[3-(4-propylpiperazino)propyl]-1H-quinoline-4-carboxamide Formula: C26H39N5O4S MolecularWeight: 517.68396

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(CC1)CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

Isomeric SMILES

CCCN1CCN(CC1)CCCNC(=O)C2=CC(=O)NC3=C2C=C(C=C3)S(=O)(=O)N4CCCCCC4

InChI

InChI=1S/C26H39N5O4S/c1-2-11-29-15-17-30(18-16-29)12-7-10-27-26(33)23-20-25(32)28-24-9-8-21(19-22(23)24)36(34,35)31-13-5-3-4-6-14-31/h8-9,19-20H,2-7,10-18H2,1H3,(H,27,33)(H,28,32)