6-chloranyl-2-oxidanylidene-1-(phenylmethyl)-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,8-naphthyridine-3-carbonitrile

Systemtic Name: 6-chloranyl-2-oxidanylidene-1-(phenylmethyl)-4-(4-thiophen-2-ylcarbonylpiperazin-1-yl)-1,8-naphthyridine-3-carbonitrile Openeye Name: 1-benzyl-6-chloro-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carbonitrile CAS Name: 6-chloro-2-oxo-4-[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-1-(phenylmethyl)-1,8-naphthyridine-3-carbonitrile IUPAC Name: 1-benzyl-6-chloro-2-oxo-4-[4-(thiophene-2-carbonyl)piperazin-1-yl]-1,8-naphthyridine-3-carbonitrile Traditional Name: 1-benzyl-6-chloro-2-keto-4-[4-(2-thenoyl)piperazino]-1,8-naphthyridine-3-carbonitrile Formula: C25H20ClN5O2S MolecularWeight: 489.9766

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C(=O)N(C3=NC=C(C=C23)Cl)CC4=CC=CC=C4)C#N)C(=O)C5=CC=CS5

Isomeric SMILES

C1CN(CCN1C2=C(C(=O)N(C3=NC=C(C=C23)Cl)CC4=CC=CC=C4)C#N)C(=O)C5=CC=CS5

InChI

InChI=1S/C25H20ClN5O2S/c26-18-13-19-22(29-8-10-30(11-9-29)25(33)21-7-4-12-34-21)20(14-27)24(32)31(23(19)28-15-18)16-17-5-2-1-3-6-17/h1-7,12-13,15H,8-11,16H2