2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-bis(oxidanylidene)-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile

Systemtic Name: 2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxidanylidene-ethyl]-1,3-bis(oxidanylidene)-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Openeye Name: 2-[2-[4-(2-naphthylsulfonyl)piperazin-1-yl]-2-oxo-ethyl]-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile CAS Name: 2-[2-[4-(2-naphthalenylsulfonyl)-1-piperazinyl]-2-oxoethyl]-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile IUPAC Name: 2-[2-(4-naphthalen-2-ylsulfonylpiperazin-1-yl)-2-oxoethyl]-1,3-dioxo-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Traditional Name: 1,3-diketo-2-[2-keto-2-[4-(2-naphthylsulfonyl)piperazino]ethyl]-6,7-dihydro-5H-pyrrolo[1,2-c]pyrimidine-4-carbonitrile Formula: C24H23N5O5S MolecularWeight: 493.53492

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C(=O)N(C(=O)N2C1)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C#N

Isomeric SMILES

C1CC2=C(C(=O)N(C(=O)N2C1)CC(=O)N3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4)C#N

InChI

InChI=1S/C24H23N5O5S/c25-15-20-21-6-3-9-28(21)24(32)29(23(20)31)16-22(30)26-10-12-27(13-11-26)35(33,34)19-8-7-17-4-1-2-5-18(17)14-19/h1-2,4-5,7-8,14H,3,6,9-13,16H2