4-piperidin-1-yl-1-[8-(4-piperidin-1-ylbutanoyl)phenoxathiin-3-yl]butan-1-one

Systemtic Name: 4-piperidin-1-yl-1-[8-(4-piperidin-1-ylbutanoyl)phenoxathiin-3-yl]butan-1-one Openeye Name: 4-(1-piperidyl)-1-[8-[4-(1-piperidyl)butanoyl]phenoxathiin-3-yl]butan-1-one CAS Name: 1-[8-[1-oxo-4-(1-piperidinyl)butyl]-3-phenoxathiinyl]-4-(1-piperidinyl)-1-butanone IUPAC Name: 4-piperidin-1-yl-1-[8-(4-piperidin-1-ylbutanoyl)phenoxathiin-3-yl]butan-1-one Traditional Name: 4-piperidino-1-[8-(4-piperidinobutanoyl)phenoxathiin-3-yl]butan-1-one Formula: C30H38N2O3S MolecularWeight: 506.69932

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCCC(=O)C2=CC3=C(C=C2)SC4=C(O3)C=CC(=C4)C(=O)CCCN5CCCCC5

Isomeric SMILES

C1CCN(CC1)CCCC(=O)C2=CC3=C(C=C2)SC4=C(O3)C=CC(=C4)C(=O)CCCN5CCCCC5

InChI

InChI=1S/C30H38N2O3S/c33-25(9-7-19-31-15-3-1-4-16-31)23-12-14-29-28(21-23)35-27-13-11-24(22-30(27)36-29)26(34)10-8-20-32-17-5-2-6-18-32/h11-14,21-22H,1-10,15-20H2