azepan-1-yl-[1-[(2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-yl)carbonyl]piperidin-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-yl)carbonyl]piperidin-4-yl]methanone Openeye Name: azepan-1-yl-[1-(2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonyl)-4-piperidyl]methanone CAS Name: 1-azepanyl-[1-[oxo-[2-(1-pyrrolyl)-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-yl]methyl]-4-piperidinyl]methanone IUPAC Name: azepan-1-yl-[1-(2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonyl)piperidin-4-yl]methanone Traditional Name: azepan-1-yl-[1-(2-pyrrol-1-yl-5,7-dihydro-4H-thieno[2,3-c]thiopyran-3-carbonyl)-4-piperidyl]methanone Formula: C24H31N3O2S2 MolecularWeight: 457.65184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(SC4=C3CCSC4)N5C=CC=C5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCN(CC2)C(=O)C3=C(SC4=C3CCSC4)N5C=CC=C5

InChI

InChI=1S/C24H31N3O2S2/c28-22(25-10-3-1-2-4-11-25)18-7-14-26(15-8-18)23(29)21-19-9-16-30-17-20(19)31-24(21)27-12-5-6-13-27/h5-6,12-13,18H,1-4,7-11,14-17H2